6-(4-bromobenzene-1-sulfonyl)-2-[(2-methylphenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-(4-bromobenzene-1-sulfonyl)-2-[(2-methylphenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
6-(4-bromobenzene-1-sulfonyl)-2-[(2-methylphenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V011-7602 |
| Compound Name: | 6-(4-bromobenzene-1-sulfonyl)-2-[(2-methylphenyl)methyl]-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 474.37 |
| Molecular Formula: | C21 H20 Br N3 O3 S |
| Smiles: | Cc1ccccc1CC1NC(C2CN(CCC=2N=1)S(c1ccc(cc1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0501 |
| logD: | 3.9709 |
| logSw: | -4.0145 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.323 |
| InChI Key: | IANAIKYUOADXEX-UHFFFAOYSA-N |