1-[4-amino-6-(5-chloro-2-methoxyanilino)-1,3,5-triazin-2-yl]-3-[(4-methylphenyl)sulfanyl]propan-2-one
Chemical Structure Depiction of
1-[4-amino-6-(5-chloro-2-methoxyanilino)-1,3,5-triazin-2-yl]-3-[(4-methylphenyl)sulfanyl]propan-2-one
1-[4-amino-6-(5-chloro-2-methoxyanilino)-1,3,5-triazin-2-yl]-3-[(4-methylphenyl)sulfanyl]propan-2-one
Compound characteristics
| Compound ID: | 5750-2676 |
| Compound Name: | 1-[4-amino-6-(5-chloro-2-methoxyanilino)-1,3,5-triazin-2-yl]-3-[(4-methylphenyl)sulfanyl]propan-2-one |
| Molecular Weight: | 429.93 |
| Molecular Formula: | C20 H20 Cl N5 O2 S |
| Smiles: | Cc1ccc(cc1)SCC(Cc1nc(N)nc(Nc2cc(ccc2OC)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6589 |
| logD: | 4.6588 |
| logSw: | -4.7886 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.024 |
| InChI Key: | IHNQYKLUQUDLGQ-UHFFFAOYSA-N |