1-[5-cyclopentyl-1-[(3-methyl-2-pyridinyl)methyl]-2-oxo-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea

HCID 19081353
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Basic information

Standard SMILES
Cc1cccc(NC(=O)NC2N=C(C3CCCC3)c3ccccc3N(Cc3ncccc3C)C2=O)c1
InChIKey
IMBNMJAWFXXDOI-UHFFFAOYSA-N
Molecular formula
C29H31N5O2
Average molar mass
481.6 g/mol

Names & identifiers

Preferred name
1-[5-cyclopentyl-1-[(3-methyl-2-pyridinyl)methyl]-2-oxo-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea
IUPAC
1-[5-cyclopentyl-1-[(3-methyl-2-pyridinyl)methyl]-2-oxo-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea

Names & synonyms

SCHEMBL8538390

Database identifiers

PubChem CID
19081353

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
86.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
5
Heavy atoms
36

Related reactions

1 records
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Compound notes

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