N-{[5-(3-chloro-4-methoxyphenyl)furan-2-yl]methyl}-1H-1,2,4-triazol-3-amine
Chemical Structure Depiction of
N-{[5-(3-chloro-4-methoxyphenyl)furan-2-yl]methyl}-1H-1,2,4-triazol-3-amine
N-{[5-(3-chloro-4-methoxyphenyl)furan-2-yl]methyl}-1H-1,2,4-triazol-3-amine
Compound characteristics
| Compound ID: | D665-1201 |
| Compound Name: | N-{[5-(3-chloro-4-methoxyphenyl)furan-2-yl]methyl}-1H-1,2,4-triazol-3-amine |
| Molecular Weight: | 304.73 |
| Molecular Formula: | C14 H13 Cl N4 O2 |
| Smiles: | COc1ccc(cc1[Cl])c1ccc(CNc2nc[nH]n2)o1 |
| Stereo: | ACHIRAL |
| logP: | 2.6488 |
| logD: | 2.6467 |
| logSw: | -3.5856 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.511 |
| InChI Key: | CYBKXERWCIVDIF-UHFFFAOYSA-N |