7-(4-chlorophenyl)-1-methyl-3-(prop-2-en-1-yl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
7-(4-chlorophenyl)-1-methyl-3-(prop-2-en-1-yl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
7-(4-chlorophenyl)-1-methyl-3-(prop-2-en-1-yl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione
Compound characteristics
Compound ID: | L559-0639 |
Compound Name: | 7-(4-chlorophenyl)-1-methyl-3-(prop-2-en-1-yl)pyrimido[4,5-d]pyrimidine-2,4(1H,3H)-dione |
Molecular Weight: | 328.76 |
Molecular Formula: | C16 H13 Cl N4 O2 |
Smiles: | CN1C(N(CC=C)C(c2cnc(c3ccc(cc3)[Cl])nc12)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.2609 |
logD: | 3.2609 |
logSw: | -3.7171 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 51.658 |
InChI Key: | GCPDFBHATWPYGN-UHFFFAOYSA-N |