2,11-dimethyl-N-[(thiophen-2-yl)methyl]dibenzo[b,f][1,4]thiazepine-8-carboxamide
Chemical Structure Depiction of
2,11-dimethyl-N-[(thiophen-2-yl)methyl]dibenzo[b,f][1,4]thiazepine-8-carboxamide
2,11-dimethyl-N-[(thiophen-2-yl)methyl]dibenzo[b,f][1,4]thiazepine-8-carboxamide
Compound characteristics
| Compound ID: | C304-1104 |
| Compound Name: | 2,11-dimethyl-N-[(thiophen-2-yl)methyl]dibenzo[b,f][1,4]thiazepine-8-carboxamide |
| Molecular Weight: | 378.51 |
| Molecular Formula: | C21 H18 N2 O S2 |
| Smiles: | CC1c2cc(C)ccc2Sc2ccc(cc2N=1)C(NCc1cccs1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1956 |
| logD: | 5.1955 |
| logSw: | -4.9239 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 32.932 |
| InChI Key: | DRJODTCETBFYKV-UHFFFAOYSA-N |