N,9-bis(3-chloro-4-methoxyphenyl)-8-ethyl-6-methyl-9H-purin-2-amine
Chemical Structure Depiction of
N,9-bis(3-chloro-4-methoxyphenyl)-8-ethyl-6-methyl-9H-purin-2-amine
N,9-bis(3-chloro-4-methoxyphenyl)-8-ethyl-6-methyl-9H-purin-2-amine
Compound characteristics
| Compound ID: | C301-9375 |
| Compound Name: | N,9-bis(3-chloro-4-methoxyphenyl)-8-ethyl-6-methyl-9H-purin-2-amine |
| Molecular Weight: | 458.35 |
| Molecular Formula: | C22 H21 Cl2 N5 O2 |
| Smiles: | CCc1nc2c(C)nc(Nc3ccc(c(c3)[Cl])OC)nc2n1c1ccc(c(c1)[Cl])OC |
| Stereo: | ACHIRAL |
| logP: | 5.7454 |
| logD: | 5.7453 |
| logSw: | -6.0097 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.971 |
| InChI Key: | YSDQJOMAQKQPMS-UHFFFAOYSA-N |