5-({[4-(3-methylbutanamido)benzene-1-sulfonyl]amino}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-({[4-(3-methylbutanamido)benzene-1-sulfonyl]amino}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-({[4-(3-methylbutanamido)benzene-1-sulfonyl]amino}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L063-0439 |
| Compound Name: | 5-({[4-(3-methylbutanamido)benzene-1-sulfonyl]amino}methyl)-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 473.57 |
| Molecular Formula: | C21 H23 N5 O4 S2 |
| Smiles: | CC(C)CC(Nc1ccc(cc1)S(NCc1nnc(C(Nc2ccccc2)=O)s1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1403 |
| logD: | 2.9521 |
| logSw: | -3.6358 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 112.237 |
| InChI Key: | JLWJQUYMGVWLQV-UHFFFAOYSA-N |