N-{3-[benzyl(butyl)amino]propyl}-11-ethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
N-{3-[benzyl(butyl)amino]propyl}-11-ethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
N-{3-[benzyl(butyl)amino]propyl}-11-ethyldibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-0312 |
| Compound Name: | N-{3-[benzyl(butyl)amino]propyl}-11-ethyldibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 485.69 |
| Molecular Formula: | C30 H35 N3 O S |
| Smiles: | CCCCN(CCCNC(c1ccc2c(c1)N=C(CC)c1ccccc1S2)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 6.3002 |
| logD: | 4.7377 |
| logSw: | -5.3723 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.425 |
| InChI Key: | LPIWSDWJRVOKSV-UHFFFAOYSA-N |