3-bromo-2-((4-methylpiperazin-1-yl)methyl)-4H-selenopheno[3,2-c]chromen-4-one

ID: ALA5274721

Chembl Id: CHEMBL5274721

Max Phase: Preclinical

Molecular Formula: C17H17BrN2O2Se

Molecular Weight: 440.20

Names and Identifiers

Canonical SMILES:  CN1CCN(Cc2[se]c3c(c2Br)c(=O)oc2ccccc23)CC1

Standard InChI:  InChI=1S/C17H17BrN2O2Se/c1-19-6-8-20(9-7-19)10-13-15(18)14-16(23-13)11-4-2-3-5-12(11)22-17(14)21/h2-5H,6-10H2,1H3

Standard InChI Key:  NJGKCMWACXUEGM-UHFFFAOYSA-N

Alternative Forms

1. Parent:

   

   ALA5274721

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Molecule Features

Natural Product: No

Oral: No

Chemical Probe: No

Parenteral: No

Molecule Type:

Topical: No

First In Class: No

Black Box: No

Chirality: No

Availability: No

Prodrug: No

Calculated Properties

Molecular Weight: 440.20

Molecular Weight (Monoisotopic): 439.9639

AlogP:

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CX Basic pKa:

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References

1. Salehian F, Nadri H, Jalili-Baleh L, Youseftabar-Miri L, Abbas Bukhari SN, Foroumadi A, Tüylü Küçükkilinç T, Sharifzadeh M, Khoobi M..  (2021)  A review: Biologically active 3,4-heterocycle-fused coumarins.,  212  [PMID:33276991] [10.1016/j.ejmech.2020.113034]

Source

Source(1):

• Scientific Literature