N~2~-[4-(1,3-benzoxazol-2-yl)phenyl]-6-chloro-N~4~-(propan-2-yl)-1,3,5-triazine-2,4-diamine
Chemical Structure Depiction of
N~2~-[4-(1,3-benzoxazol-2-yl)phenyl]-6-chloro-N~4~-(propan-2-yl)-1,3,5-triazine-2,4-diamine
N~2~-[4-(1,3-benzoxazol-2-yl)phenyl]-6-chloro-N~4~-(propan-2-yl)-1,3,5-triazine-2,4-diamine
Compound characteristics
| Compound ID: | 6412-0039 |
| Compound Name: | N~2~-[4-(1,3-benzoxazol-2-yl)phenyl]-6-chloro-N~4~-(propan-2-yl)-1,3,5-triazine-2,4-diamine |
| Molecular Weight: | 380.83 |
| Molecular Formula: | C19 H17 Cl N6 O |
| Smiles: | CC(C)Nc1nc(Nc2ccc(cc2)c2nc3ccccc3o2)nc(n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.5727 |
| logD: | 5.5727 |
| logSw: | -6.1802 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.31 |
| InChI Key: | WRCPKXFLJOGOHQ-UHFFFAOYSA-N |