N~2~-(3-chloro-4-methylphenyl)-N~4~-[2-(cyclohex-1-en-1-yl)ethyl]-6-(pyrrolidin-1-yl)-1,3,5-triazine-2,4-diamine
Chemical Structure Depiction of
N~2~-(3-chloro-4-methylphenyl)-N~4~-[2-(cyclohex-1-en-1-yl)ethyl]-6-(pyrrolidin-1-yl)-1,3,5-triazine-2,4-diamine
N~2~-(3-chloro-4-methylphenyl)-N~4~-[2-(cyclohex-1-en-1-yl)ethyl]-6-(pyrrolidin-1-yl)-1,3,5-triazine-2,4-diamine
Compound characteristics
| Compound ID: | K647-0117 |
| Compound Name: | N~2~-(3-chloro-4-methylphenyl)-N~4~-[2-(cyclohex-1-en-1-yl)ethyl]-6-(pyrrolidin-1-yl)-1,3,5-triazine-2,4-diamine |
| Molecular Weight: | 412.96 |
| Molecular Formula: | C22 H29 Cl N6 |
| Smiles: | Cc1ccc(cc1[Cl])Nc1nc(NCCC2CCCCC=2)nc(n1)N1CCCC1 |
| Stereo: | ACHIRAL |
| logP: | 7.371 |
| logD: | 7.3705 |
| logSw: | -6.6417 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.299 |
| InChI Key: | QZRPBZGSLLMSRU-UHFFFAOYSA-N |