6-[2-(4-chlorophenyl)ethyl]-1,3-dimethyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
6-[2-(4-chlorophenyl)ethyl]-1,3-dimethyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
6-[2-(4-chlorophenyl)ethyl]-1,3-dimethyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | C612-1297 |
| Compound Name: | 6-[2-(4-chlorophenyl)ethyl]-1,3-dimethyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 334.8 |
| Molecular Formula: | C16 H19 Cl N4 O2 |
| Smiles: | CN1C2=C(CN(CCc3ccc(cc3)[Cl])CN2)C(N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.08 |
| logD: | 1.9713 |
| logSw: | -3.0325 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.184 |
| InChI Key: | MAYRWKJXPPBWFK-UHFFFAOYSA-N |