N-[4-[(Dibenz[b,f] [1,4]thiazepin-10(11H)-yl)carbonyl]phenyl]-2,4-dichlorobenzamide

HCID 67625596

Basic information

Standard SMILES
O=C(Nc1ccc(C(=O)N2Cc3ccccc3Sc3ccccc32)cc1)c1ccc(Cl)cc1Cl
InChIKey
KSYPMTIZWJDGGY-UHFFFAOYSA-N
Molecular formula
C27H18Cl2N2O2S
Average molar mass
505.4 g/mol

Names & identifiers

Preferred name
N-[4-[(Dibenz[b,f] [1,4]thiazepin-10(11H)-yl)carbonyl]phenyl]-2,4-dichlorobenzamide
IUPAC
N-[4-(6H-benzo[b][1,4]benzothiazepine-5-carbonyl)phenyl]-2,4-dichlorobenzamide

Names & synonyms

SCHEMBL8562629KSYPMTIZWJDGGY-UHFFFAOYSA-NN-[4-[(Dibenz[b,f] [1,4]thiazepin-10(11H)-yl)carbonyl]phenyl]-2,4-dichlorobenzamideN-[4-[(Dibenz[b,f][1,4]thiazepin-10(11H)-yl)-carbonyl]phenyl]-2 4-dichlorobenzamideN-[4-[(Dibenz[b,f][1,4]thiazepin-10(11H)-yl)-carbonyl]phenyl]-2,4-dichlorobenzamideN-[4-[(Dibenz[b,f][1,4]thiazepin-10(11H)-yl)carbonyl]phenyl]-2,4-dichlorobenzamide

Database identifiers

PubChem CID
67625596

Properties

Computed structural properties

XLogP
6.7
Topological polar surface area
74.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
34

Related reactions

10 records

Compound notes

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