N-(5-methyl-1,2-oxazol-3-yl)-2-{[4-oxo-3-(prop-2-en-1-yl)-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(5-methyl-1,2-oxazol-3-yl)-2-{[4-oxo-3-(prop-2-en-1-yl)-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide
N-(5-methyl-1,2-oxazol-3-yl)-2-{[4-oxo-3-(prop-2-en-1-yl)-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | G864-0235 |
| Compound Name: | N-(5-methyl-1,2-oxazol-3-yl)-2-{[4-oxo-3-(prop-2-en-1-yl)-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 395.44 |
| Molecular Formula: | C19 H17 N5 O3 S |
| Smiles: | Cc1cc(NC(CSC2=Nc3c4ccccc4[nH]c3C(N2CC=C)=O)=O)no1 |
| Stereo: | ACHIRAL |
| logP: | 2.8467 |
| logD: | 2.8354 |
| logSw: | -3.3527 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.924 |
| InChI Key: | ZKFJVSXQMZMYRV-UHFFFAOYSA-N |