5-{[(4-tert-butylbenzene-1-sulfonyl)amino]methyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-{[(4-tert-butylbenzene-1-sulfonyl)amino]methyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-{[(4-tert-butylbenzene-1-sulfonyl)amino]methyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L063-0096 |
| Compound Name: | 5-{[(4-tert-butylbenzene-1-sulfonyl)amino]methyl}-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 444.57 |
| Molecular Formula: | C21 H24 N4 O3 S2 |
| Smiles: | Cc1ccc(cc1)NC(c1nnc(CNS(c2ccc(cc2)C(C)(C)C)(=O)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9207 |
| logD: | 4.7849 |
| logSw: | -4.5338 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.087 |
| InChI Key: | RDNKSDZUFVTPKI-UHFFFAOYSA-N |