1-{4-[2-(4-chlorophenyl)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-sulfonyl]phenyl}ethan-1-one
Chemical Structure Depiction of
1-{4-[2-(4-chlorophenyl)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-sulfonyl]phenyl}ethan-1-one
1-{4-[2-(4-chlorophenyl)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-sulfonyl]phenyl}ethan-1-one
Compound characteristics
| Compound ID: | M569-0113 |
| Compound Name: | 1-{4-[2-(4-chlorophenyl)-7,8-dihydropyrido[4,3-d]pyrimidine-6(5H)-sulfonyl]phenyl}ethan-1-one |
| Molecular Weight: | 427.91 |
| Molecular Formula: | C21 H18 Cl N3 O3 S |
| Smiles: | CC(c1ccc(cc1)S(N1CCc2c(C1)cnc(c1ccc(cc1)[Cl])n2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.734 |
| logD: | 3.734 |
| logSw: | -4.284 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.76 |
| InChI Key: | PHPXTSVGMDSKHG-UHFFFAOYSA-N |