N-(1-ethyl-3,3,5-trimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-benzo[b][1,4]diazepin-7-ylmethyl)-N-(2-pyridin-3-ylethyl)benzamide hydrochloride

HCID 66960481
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Basic information

Standard SMILES
CCN1C(=O)C(C)(C)C(=O)N(C)c2cc(CN(CCc3cccnc3)C(=O)c3ccccc3)ccc21.Cl
InChIKey
FBCRZSSUSYFUNL-UHFFFAOYSA-N
Molecular formula
C29H33ClN4O3
Average molar mass
521 g/mol
Monoisotopic mass
520.2241186

Names & identifiers

Preferred name
N-(1-ethyl-3,3,5-trimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-benzo[b][1,4]diazepin-7-ylmethyl)-N-(2-pyridin-3-ylethyl)benzamide hydrochloride
IUPAC
N-[(1-ethyl-3,3,5-trimethyl-2,4-dioxo-1,5-benzodiazepin-7-yl)methyl]-N-(2-pyridin-3-ylethyl)benzamide;hydrochloride

Names & synonyms

SCHEMBL1238136FBCRZSSUSYFUNL-UHFFFAOYSA-NN-(1-ethyl-3,3,5-trimethyl-2,4-dioxo-2,3,4,5-tetrahydro-1H-benzo[b][1,4]diazepin-7-ylmethyl)-N-(2-pyridin-3-ylethyl)benzamide hydrochloride

Database identifiers

PubChem CID
66960481

Properties

Computed structural properties

Topological polar surface area
73.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
37

Related reactions

2 records
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Compound notes

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