2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]propanamide
Chemical Structure Depiction of
2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]propanamide
2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]propanamide
Compound characteristics
| Compound ID: | J084-0479 |
| Compound Name: | 2-{[5-(4-methoxyphenyl)[1,2,4]triazolo[4,3-c]quinazolin-3-yl]sulfanyl}-N-[(oxolan-2-yl)methyl]propanamide |
| Molecular Weight: | 463.56 |
| Molecular Formula: | C24 H25 N5 O3 S |
| Smiles: | CC(C(NCC1CCCO1)=O)Sc1nnc2c3ccccc3nc(c3ccc(cc3)OC)n12 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6677 |
| logD: | 3.6629 |
| logSw: | -3.9943 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.193 |
| InChI Key: | SQXJNKPXPXBKFG-UHFFFAOYSA-N |