4-(morpholine-4-sulfonyl)-N-[(4-phenyl-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl]benzamide
Chemical Structure Depiction of
4-(morpholine-4-sulfonyl)-N-[(4-phenyl-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl]benzamide
4-(morpholine-4-sulfonyl)-N-[(4-phenyl-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl]benzamide
Compound characteristics
| Compound ID: | 2515-5395 |
| Compound Name: | 4-(morpholine-4-sulfonyl)-N-[(4-phenyl-5-sulfanylidene-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl]benzamide |
| Molecular Weight: | 459.54 |
| Molecular Formula: | C20 H21 N5 O4 S2 |
| Smiles: | C(C1=NNC(N1c1ccccc1)=S)NC(c1ccc(cc1)S(N1CCOCC1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6011 |
| logD: | 0.7505 |
| logSw: | -2.5111 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.134 |
| InChI Key: | PUGWCRNGVMEBIW-UHFFFAOYSA-N |