2,9-dimethyl-3-[(4-methyl-5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Chemical Structure Depiction of
2,9-dimethyl-3-[(4-methyl-5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
2,9-dimethyl-3-[(4-methyl-5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one
Compound characteristics
| Compound ID: | D483-1536 |
| Compound Name: | 2,9-dimethyl-3-[(4-methyl-5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-4H-pyrido[1,2-a]pyrimidin-4-one |
| Molecular Weight: | 428.51 |
| Molecular Formula: | C20 H24 N6 O3 S |
| Smiles: | CC1=CC=CN2C1=NC(C)=C(Cc1nnc(n1C)SCC(N1CCOCC1)=O)C2=O |
| Stereo: | ACHIRAL |
| logP: | -0.0579 |
| logD: | -0.0579 |
| logSw: | -0.9076 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 74.246 |
| InChI Key: | AGLQEADJPVOCQQ-UHFFFAOYSA-N |