N-(2-methylphenyl)-N'-(3-{3-[(propan-2-yl)oxy]-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl}phenyl)urea
Chemical Structure Depiction of
N-(2-methylphenyl)-N'-(3-{3-[(propan-2-yl)oxy]-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl}phenyl)urea
N-(2-methylphenyl)-N'-(3-{3-[(propan-2-yl)oxy]-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl}phenyl)urea
Compound characteristics
| Compound ID: | V028-5006 |
| Compound Name: | N-(2-methylphenyl)-N'-(3-{3-[(propan-2-yl)oxy]-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl}phenyl)urea |
| Molecular Weight: | 433.53 |
| Molecular Formula: | C23 H23 N5 O2 S |
| Salt: | not_available |
| Smiles: | CC(C)Oc1nc(c2cccs2)n(c2cccc(c2)NC(Nc2ccccc2C)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 5.861 |
| logD: | 5.861 |
| logSw: | -5.4666 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.116 |
| InChI Key: | NNGQEYMSLJQCGD-UHFFFAOYSA-N |