N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)-4-(piperidine-1-sulfonyl)benzamide
Chemical Structure Depiction of
N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)-4-(piperidine-1-sulfonyl)benzamide
N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)-4-(piperidine-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | 0800-1209 |
| Compound Name: | N-(5-{[(5-nitrothiophen-2-yl)methylidene]amino}-1,3,4-thiadiazol-2-yl)-4-(piperidine-1-sulfonyl)benzamide |
| Molecular Weight: | 506.58 |
| Molecular Formula: | C19 H18 N6 O5 S3 |
| Smiles: | C1CCN(CC1)S(c1ccc(cc1)C(Nc1nnc(/N=C/c2ccc([N+]([O-])=O)s2)s1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7724 |
| logD: | 2.1444 |
| logSw: | -4.0346 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 121.505 |
| InChI Key: | RTFZMUTVRCEKFB-UHFFFAOYSA-N |