N-{4-[3-(2-methoxyethoxy)-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-N'-(4-methoxyphenyl)urea
Chemical Structure Depiction of
N-{4-[3-(2-methoxyethoxy)-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-N'-(4-methoxyphenyl)urea
N-{4-[3-(2-methoxyethoxy)-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-N'-(4-methoxyphenyl)urea
Compound characteristics
| Compound ID: | V027-4544 |
| Compound Name: | N-{4-[3-(2-methoxyethoxy)-5-(thiophen-2-yl)-1H-1,2,4-triazol-1-yl]phenyl}-N'-(4-methoxyphenyl)urea |
| Molecular Weight: | 465.53 |
| Molecular Formula: | C23 H23 N5 O4 S |
| Salt: | not_available |
| Smiles: | COCCOc1nc(c2cccs2)n(c2ccc(cc2)NC(Nc2ccc(cc2)OC)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5499 |
| logD: | 4.5499 |
| logSw: | -4.317 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.315 |
| InChI Key: | BBEXUMSHJIXHTC-UHFFFAOYSA-N |