2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)ethan-1-one
Chemical Structure Depiction of
2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)ethan-1-one
2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)ethan-1-one
Compound characteristics
| Compound ID: | 3613-0040 |
| Compound Name: | 2-[(6-amino-1,3-benzothiazol-2-yl)sulfanyl]-1-(10,11-dihydro-5H-dibenzo[b,f]azepin-5-yl)ethan-1-one |
| Molecular Weight: | 417.55 |
| Molecular Formula: | C23 H19 N3 O S2 |
| Smiles: | C1Cc2ccccc2N(C(CSc2nc3ccc(cc3s2)N)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 5.362 |
| logD: | 5.3619 |
| logSw: | -5.6734 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.561 |
| InChI Key: | KDQLOBGPHLWMBN-UHFFFAOYSA-N |