N-(5-acetyl-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl)-2-chloro-5-(methylsulfanyl)benzamide
Chemical Structure Depiction of
N-(5-acetyl-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl)-2-chloro-5-(methylsulfanyl)benzamide
N-(5-acetyl-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl)-2-chloro-5-(methylsulfanyl)benzamide
Compound characteristics
| Compound ID: | 8012-0944 |
| Compound Name: | N-(5-acetyl-10,11-dihydro-5H-dibenzo[b,f]azepin-3-yl)-2-chloro-5-(methylsulfanyl)benzamide |
| Molecular Weight: | 436.96 |
| Molecular Formula: | C24 H21 Cl N2 O2 S |
| Smiles: | CC(N1c2ccccc2CCc2ccc(cc12)NC(c1cc(ccc1[Cl])SC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8522 |
| logD: | 5.8521 |
| logSw: | -5.9124 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.031 |
| InChI Key: | DSZOUHIRZSBDTA-UHFFFAOYSA-N |