2-(4-bromophenyl)-9-(methoxymethyl)-7-methyl-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
Chemical Structure Depiction of
2-(4-bromophenyl)-9-(methoxymethyl)-7-methyl-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
2-(4-bromophenyl)-9-(methoxymethyl)-7-methyl-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one
Compound characteristics
Compound ID: | D149-0022 |
Compound Name: | 2-(4-bromophenyl)-9-(methoxymethyl)-7-methyl-2,3-dihydropyrido[3',2':4,5]thieno[3,2-d]pyrimidin-4(1H)-one |
Molecular Weight: | 418.31 |
Molecular Formula: | C18 H16 Br N3 O2 S |
Smiles: | Cc1cc(COC)c2c3c(C(NC(c4ccc(cc4)[Br])N3)=O)sc2n1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.3905 |
logD: | 3.3867 |
logSw: | -3.8725 |
Hydrogen bond acceptors count: | 4 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 52.076 |
InChI Key: | KIKYNFBMTZMFMZ-INIZCTEOSA-N |