1-(3-chloro-2-methylphenyl)-6-(2-phenylethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-(3-chloro-2-methylphenyl)-6-(2-phenylethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
1-(3-chloro-2-methylphenyl)-6-(2-phenylethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 8019-1750 |
| Compound Name: | 1-(3-chloro-2-methylphenyl)-6-(2-phenylethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 396.88 |
| Molecular Formula: | C21 H21 Cl N4 O2 |
| Smiles: | Cc1c(cccc1[Cl])N1C2=C(CN(CCc3ccccc3)CN2)C(NC1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4048 |
| logD: | 3.392 |
| logSw: | -3.7252 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 53.149 |
| InChI Key: | CRPQCLSACZSZHQ-UHFFFAOYSA-N |