N'-(5-chloro-2-methoxyphenyl)-N-[(4-methylphenyl)methyl]-N-[(pyridin-3-yl)methyl]thiourea
Chemical Structure Depiction of
N'-(5-chloro-2-methoxyphenyl)-N-[(4-methylphenyl)methyl]-N-[(pyridin-3-yl)methyl]thiourea
N'-(5-chloro-2-methoxyphenyl)-N-[(4-methylphenyl)methyl]-N-[(pyridin-3-yl)methyl]thiourea
Compound characteristics
| Compound ID: | C087-0553 |
| Compound Name: | N'-(5-chloro-2-methoxyphenyl)-N-[(4-methylphenyl)methyl]-N-[(pyridin-3-yl)methyl]thiourea |
| Molecular Weight: | 411.95 |
| Molecular Formula: | C22 H22 Cl N3 O S |
| Smiles: | Cc1ccc(CN(Cc2cccnc2)C(Nc2cc(ccc2OC)[Cl])=S)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.81 |
| logD: | 4.8094 |
| logSw: | -4.8421 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 26.8783 |
| InChI Key: | VPNPDOWXGQZPKR-UHFFFAOYSA-N |