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1-[4-(Morpholine-4-carbonyl)phenyl]-3-phenylurea , CAS No.354766-81-7
Basic Description
| Synonyms | 1-[4-(morpholine-4-carbonyl)phenyl]-3-phenylurea | 1-[4-(morpholin-4-ylcarbonyl)phenyl]-3-phenylurea | 1-(4-(morpholine-4-carbonyl)phenyl)-3-phenylurea | SMR000122244 | CBMicro_042992 | Cambridge id 6052636 | Oprea1_366365 | Oprea1_458073 | MLS000525370 | |
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Associated Targets(Human)
Associated Targets(non-human)
Mechanisms of Action
| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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Names and Identifiers
| IUPAC Name | 1-[4-(morpholine-4-carbonyl)phenyl]-3-phenylurea |
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| INCHI | InChI=1S/C18H19N3O3/c22-17(21-10-12-24-13-11-21)14-6-8-16(9-7-14)20-18(23)19-15-4-2-1-3-5-15/h1-9H,10-13H2,(H2,19,20,23) |
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| InChi Key | AJFZQQYWAWELBA-UHFFFAOYSA-N |
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| Canonical SMILES | C1COCCN1C(=O)C2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3 |
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| Isomeric SMILES | C1COCCN1C(=O)C2=CC=C(C=C2)NC(=O)NC3=CC=CC=C3 |
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| PubChem CID | 839616 |
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| Molecular Weight | 325.4 |
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Certificates（CoA,COO,BSE/TSE and Analysis Chart)
Chemical and Physical Properties
| Molecular Weight | 325.400 g/mol |
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| XLogP3 | 1.600 |
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| Hydrogen Bond Donor Count | 2 |
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| Hydrogen Bond Acceptor Count | 3 |
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| Rotatable Bond Count | 3 |
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| Exact Mass | 325.143 Da |
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| Monoisotopic Mass | 325.143 Da |
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| Topological Polar Surface Area | 70.700 Ų |
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| Heavy Atom Count | 24 |
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| Formal Charge | 0 |
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| Complexity | 423.000 |
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| Isotope Atom Count | 0 |
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| Defined Atom Stereocenter Count | 0 |
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| Undefined Atom Stereocenter Count | 0 |
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| Defined Bond Stereocenter Count | 0 |
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| Undefined Bond Stereocenter Count | 0 |
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| The total count of all stereochemical bonds | 0 |
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| Covalently-Bonded Unit Count | 1 |
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