N-(10-cyclopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-N~2~-(4-methylbenzene-1-sulfonyl)alaninamide
Chemical Structure Depiction of
N-(10-cyclopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-N~2~-(4-methylbenzene-1-sulfonyl)alaninamide
N-(10-cyclopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-N~2~-(4-methylbenzene-1-sulfonyl)alaninamide
Compound characteristics
| Compound ID: | G943-0473 |
| Compound Name: | N-(10-cyclopropyl-11-oxo-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)-N~2~-(4-methylbenzene-1-sulfonyl)alaninamide |
| Molecular Weight: | 507.63 |
| Molecular Formula: | C26 H25 N3 O4 S2 |
| Smiles: | CC(C(Nc1ccc2c(c1)Sc1ccccc1C(N2C1CC1)=O)=O)NS(c1ccc(C)cc1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9942 |
| logD: | 4.994 |
| logSw: | -4.5632 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.451 |
| InChI Key: | AHHNREIFZNARKA-KRWDZBQOSA-N |