N-{5-[cyclohexyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(2-methoxy-4-nitrophenyl)urea
Chemical Structure Depiction of
N-{5-[cyclohexyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(2-methoxy-4-nitrophenyl)urea
N-{5-[cyclohexyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(2-methoxy-4-nitrophenyl)urea
Compound characteristics
| Compound ID: | E002-1832 |
| Compound Name: | N-{5-[cyclohexyl(methyl)amino]-1,3,4-thiadiazol-2-yl}-N'-(2-methoxy-4-nitrophenyl)urea |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C17 H22 N6 O4 S |
| Smiles: | CN(C1CCCCC1)c1nnc(NC(Nc2ccc(cc2OC)[N+]([O-])=O)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.266 |
| logD: | 4.2615 |
| logSw: | -4.3359 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.222 |
| InChI Key: | OKQVKBHEMMMGFX-UHFFFAOYSA-N |