N-(3-acetamidophenyl)-2-{[3-(2-methoxyethyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(3-acetamidophenyl)-2-{[3-(2-methoxyethyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide
N-(3-acetamidophenyl)-2-{[3-(2-methoxyethyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G864-0143 |
| Compound Name: | N-(3-acetamidophenyl)-2-{[3-(2-methoxyethyl)-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 465.53 |
| Molecular Formula: | C23 H23 N5 O4 S |
| Smiles: | CC(Nc1cccc(c1)NC(CSC1=Nc2c3ccccc3[nH]c2C(N1CCOC)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0121 |
| logD: | 2.0121 |
| logSw: | -2.7728 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 88.733 |
| InChI Key: | JGSMLTGOGZYMCA-UHFFFAOYSA-N |