N-{2-oxo-2-[(11-oxo-10-propyl-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)amino]ethyl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{2-oxo-2-[(11-oxo-10-propyl-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)amino]ethyl}thiophene-2-carboxamide
N-{2-oxo-2-[(11-oxo-10-propyl-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)amino]ethyl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | G943-0335 |
| Compound Name: | N-{2-oxo-2-[(11-oxo-10-propyl-10,11-dihydrodibenzo[b,f][1,4]thiazepin-7-yl)amino]ethyl}thiophene-2-carboxamide |
| Molecular Weight: | 451.57 |
| Molecular Formula: | C23 H21 N3 O3 S2 |
| Smiles: | CCCN1C(c2ccccc2Sc2cc(ccc12)NC(CNC(c1cccs1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9374 |
| logD: | 4.9374 |
| logSw: | -4.4734 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 64.232 |
| InChI Key: | RKIWAUCJJQTKLY-UHFFFAOYSA-N |