3-(4-chlorophenyl)-7-{[(naphthalen-1-yl)methyl]sulfanyl}pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
3-(4-chlorophenyl)-7-{[(naphthalen-1-yl)methyl]sulfanyl}pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
3-(4-chlorophenyl)-7-{[(naphthalen-1-yl)methyl]sulfanyl}pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | 7682-0143 |
| Compound Name: | 3-(4-chlorophenyl)-7-{[(naphthalen-1-yl)methyl]sulfanyl}pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 446.91 |
| Molecular Formula: | C23 H15 Cl N4 O2 S |
| Smiles: | C(c1cccc2ccccc12)Sc1ncc2C(N(C(Nc2n1)=O)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 5.0436 |
| logD: | 3.6991 |
| logSw: | -5.2545 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.716 |
| InChI Key: | ZOKIEWVJVMZJAZ-UHFFFAOYSA-N |