N-[(2-chlorophenyl)methyl]-2-methyl-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-2-methyl-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide
N-[(2-chlorophenyl)methyl]-2-methyl-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-1315 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-2-methyl-11-propyldibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 434.99 |
| Molecular Formula: | C25 H23 Cl N2 O S |
| Smiles: | CCCC1c2cc(C)ccc2Sc2ccc(cc2N=1)C(NCc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 6.9074 |
| logD: | 6.9071 |
| logSw: | -6.1719 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.644 |
| InChI Key: | FAWQJNMMADIVFM-UHFFFAOYSA-N |