7-chloro-5-(2-methylbenzyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
Basic information
- CAS
341968-15-8- Standard SMILES
Cc1ccccc1CN1C(=O)CCSc2ccc(Cl)cc21- InChIKey
AYCUFLDOLQOZRB-UHFFFAOYSA-N- Molecular formula
- C17H16ClNOS
- Average molar mass
- 317.8 g/mol
Names & identifiers
- Preferred name
- 7-chloro-5-(2-methylbenzyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
- IUPAC
- 7-chloro-5-[(2-methylphenyl)methyl]-2,3-dihydro-1,5-benzothiazepin-4-one
- English name
- 7-Chloro-5-(2-methylbenzyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
- Molecular formula
- C17H16ClNOS
- Molecular weight
- 317.83
Names & synonyms
341968-15-87-chloro-5-(2-methylbenzyl)-2,3-dihydro-1,5-benzothiazepin-4(5H)-one7-chloro-5-[(2-methylphenyl)methyl]-2,3-dihydro-1,5-benzothiazepin-4-one7-chloro-5-[(2-methylphenyl)methyl]-2,3,4,5-tetrahydro-1,5-benzothiazepin-4-oneAKOS00507570210N-374S7-Chloro-5-(2-methylbenzyl)-2,3-dihydrobenzo[b][1,4]thiazepin-4(5H)-one1,5-Benzothiazepin-4(5H)-one, 7-chloro-2,3-dihydro-5-[(2-methylphenyl)methyl]-
Database identifiers
- CAS
341968-15-8
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 45.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 378
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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