4-{[5-(2,3-dichlorophenyl)furan-2-yl]methylidene}-5-methyl-2-(1H-tetrazol-5-yl)-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{[5-(2,3-dichlorophenyl)furan-2-yl]methylidene}-5-methyl-2-(1H-tetrazol-5-yl)-2,4-dihydro-3H-pyrazol-3-one
4-{[5-(2,3-dichlorophenyl)furan-2-yl]methylidene}-5-methyl-2-(1H-tetrazol-5-yl)-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 8017-6226 |
| Compound Name: | 4-{[5-(2,3-dichlorophenyl)furan-2-yl]methylidene}-5-methyl-2-(1H-tetrazol-5-yl)-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 389.2 |
| Molecular Formula: | C16 H10 Cl2 N6 O2 |
| Smiles: | CC1/C(=C/c2ccc(c3cccc(c3[Cl])[Cl])o2)C(N(c2nnn[nH]2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5437 |
| logD: | 2.1008 |
| logSw: | -4.2376 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.468 |
| InChI Key: | CPTKRDAXBDAYQM-UHFFFAOYSA-N |