N-benzyl-N'-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N-methylurea
Chemical Structure Depiction of
N-benzyl-N'-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N-methylurea
N-benzyl-N'-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N-methylurea
Compound characteristics
| Compound ID: | C799-0076 |
| Compound Name: | N-benzyl-N'-(10-benzyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-8-yl)-N-methylurea |
| Molecular Weight: | 479.6 |
| Molecular Formula: | C29 H25 N3 O2 S |
| Smiles: | CN(Cc1ccccc1)C(Nc1ccc2c(c1)N(Cc1ccccc1)C(c1ccccc1S2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4907 |
| logD: | 6.4907 |
| logSw: | -5.6171 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.372 |
| InChI Key: | UEKUJRUXXYWBTE-UHFFFAOYSA-N |