2-chloro-N-[(furan-2-yl)methyl]-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
2-chloro-N-[(furan-2-yl)methyl]-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
2-chloro-N-[(furan-2-yl)methyl]-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-0610 |
| Compound Name: | 2-chloro-N-[(furan-2-yl)methyl]-11-methyldibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 382.87 |
| Molecular Formula: | C20 H15 Cl N2 O2 S |
| Smiles: | CC1c2cc(ccc2Sc2ccc(cc2N=1)C(NCc1ccco1)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.2456 |
| logD: | 5.2455 |
| logSw: | -5.4975 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.662 |
| InChI Key: | CFLSRSKDKREXFW-UHFFFAOYSA-N |