ethyl 4-{[4-amino-6-(4-chloroanilino)-1,3,5-triazin-2-yl]methyl}piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-{[4-amino-6-(4-chloroanilino)-1,3,5-triazin-2-yl]methyl}piperazine-1-carboxylate
ethyl 4-{[4-amino-6-(4-chloroanilino)-1,3,5-triazin-2-yl]methyl}piperazine-1-carboxylate
Compound characteristics
| Compound ID: | Y020-7203 |
| Compound Name: | ethyl 4-{[4-amino-6-(4-chloroanilino)-1,3,5-triazin-2-yl]methyl}piperazine-1-carboxylate |
| Molecular Weight: | 391.86 |
| Molecular Formula: | C17 H22 Cl N7 O2 |
| Smiles: | CCOC(N1CCN(CC1)Cc1nc(N)nc(Nc2ccc(cc2)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6986 |
| logD: | 2.6778 |
| logSw: | -3.52 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.121 |
| InChI Key: | VSPINSCPPDNJIJ-UHFFFAOYSA-N |