N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide
N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | G786-1213 |
| Compound Name: | N-[4-(5-chlorothiophen-2-yl)-1,3-thiazol-2-yl]-5-nitro-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 421.9 |
| Molecular Formula: | C16 H8 Cl N3 O3 S3 |
| Smiles: | c1cc2c(cc1[N+]([O-])=O)cc(C(Nc1nc(cs1)c1ccc(s1)[Cl])=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 6.2284 |
| logD: | 6.2282 |
| logSw: | -6.4242 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.251 |
| InChI Key: | AHBUULGWLPNXJU-UHFFFAOYSA-N |