1-methyl-7-(thiophen-2-yl)-3-[(2,4,6-trimethylphenyl)methyl]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
1-methyl-7-(thiophen-2-yl)-3-[(2,4,6-trimethylphenyl)methyl]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
1-methyl-7-(thiophen-2-yl)-3-[(2,4,6-trimethylphenyl)methyl]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | L559-0563 |
| Compound Name: | 1-methyl-7-(thiophen-2-yl)-3-[(2,4,6-trimethylphenyl)methyl]pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 392.48 |
| Molecular Formula: | C21 H20 N4 O2 S |
| Smiles: | Cc1cc(C)c(CN2C(c3cnc(c4cccs4)nc3N(C)C2=O)=O)c(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.9225 |
| logD: | 4.9225 |
| logSw: | -4.4697 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.427 |
| InChI Key: | DVNMXTMPAYEQFE-UHFFFAOYSA-N |