5-[4-[(1-Methylpiperidin-4-yl)carbonylamino]phenyl]-1H-naphtho[1,2-b][1,4]diazepine-2,4(3H,5H)-dione

HCID 117699091
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Basic information

Standard SMILES
CN1CCC(C(=O)Nc2ccc(N3C(=O)CC(=O)Nc4c3ccc3ccccc43)cc2)CC1
InChIKey
SXXABNBGZFZEKD-UHFFFAOYSA-N
Molecular formula
C26H26N4O3
Average molar mass
442.5 g/mol

Names & identifiers

Preferred name
5-[4-[(1-Methylpiperidin-4-yl)carbonylamino]phenyl]-1H-naphtho[1,2-b][1,4]diazepine-2,4(3H,5H)-dione
IUPAC
N-[4-(2,4-dioxo-1H-benzo[g][1,5]benzodiazepin-5-yl)phenyl]-1-methylpiperidine-4-carboxamide

Names & synonyms

SCHEMBL16239005SXXABNBGZFZEKD-UHFFFAOYSA-N5-[4-[(1-Methylpiperidin-4-yl)carbonylamino]phenyl]-1H-naphtho[1,2-b][1,4]diazepine-2,4(3H,5H)-dione

Database identifiers

PubChem CID
117699091

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
81.8 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
33

Related reactions

1 records
New reaction record

Linked notes

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