N'-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N-butyl-N-methylurea
Chemical Structure Depiction of
N'-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N-butyl-N-methylurea
N'-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N-butyl-N-methylurea
Compound characteristics
| Compound ID: | E006-0569 |
| Compound Name: | N'-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N-butyl-N-methylurea |
| Molecular Weight: | 445.58 |
| Molecular Formula: | C26 H27 N3 O2 S |
| Smiles: | CCCCN(C)C(Nc1ccc2c(c1)N(Cc1ccccc1)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9232 |
| logD: | 5.9232 |
| logSw: | -5.3152 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.622 |
| InChI Key: | WAKQVSLVSNHPSK-UHFFFAOYSA-N |