N-[(4-methylphenyl)methyl]-2-({6-[(3-methylphenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-2-({6-[(3-methylphenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide
N-[(4-methylphenyl)methyl]-2-({6-[(3-methylphenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | G071-0354 |
| Compound Name: | N-[(4-methylphenyl)methyl]-2-({6-[(3-methylphenyl)methyl]-5,5-dioxo-5,6-dihydro-5lambda~6~-pyrimido[5,4-c][2,1]benzothiazin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 530.67 |
| Molecular Formula: | C28 H26 N4 O3 S2 |
| Smiles: | Cc1ccc(CNC(CSc2ncc3c(c4ccccc4N(Cc4cccc(C)c4)S3(=O)=O)n2)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1452 |
| logD: | 5.1452 |
| logSw: | -4.822 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.638 |
| InChI Key: | NQYJZHWVOSXBCB-UHFFFAOYSA-N |