(2-chloro-11-methyldibenzo[b,f][1,4]thiazepin-8-yl)(4-methylpiperidin-1-yl)methanone
Chemical Structure Depiction of
(2-chloro-11-methyldibenzo[b,f][1,4]thiazepin-8-yl)(4-methylpiperidin-1-yl)methanone
(2-chloro-11-methyldibenzo[b,f][1,4]thiazepin-8-yl)(4-methylpiperidin-1-yl)methanone
Compound characteristics
| Compound ID: | C304-0690 |
| Compound Name: | (2-chloro-11-methyldibenzo[b,f][1,4]thiazepin-8-yl)(4-methylpiperidin-1-yl)methanone |
| Molecular Weight: | 384.93 |
| Molecular Formula: | C21 H21 Cl N2 O S |
| Smiles: | CC1CCN(CC1)C(c1ccc2c(c1)N=C(C)c1cc(ccc1S2)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.1564 |
| logD: | 5.1561 |
| logSw: | -5.3899 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 24.1486 |
| InChI Key: | UNFQVDGUMRZUHH-UHFFFAOYSA-N |