2-(4-methylbenzene-1-sulfonyl)-3-[4-oxo-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Chemical Structure Depiction of
2-(4-methylbenzene-1-sulfonyl)-3-[4-oxo-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
2-(4-methylbenzene-1-sulfonyl)-3-[4-oxo-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile
Compound characteristics
| Compound ID: | Y070-1705 |
| Compound Name: | 2-(4-methylbenzene-1-sulfonyl)-3-[4-oxo-2-(piperidin-1-yl)-4H-pyrido[1,2-a]pyrimidin-3-yl]prop-2-enenitrile |
| Molecular Weight: | 434.52 |
| Molecular Formula: | C23 H22 N4 O3 S |
| Smiles: | Cc1ccc(cc1)S(C(=C\C1=C(N=C2C=CC=CN2C1=O)N1CCCCC1)\C#N)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2023 |
| logD: | 3.2023 |
| logSw: | -3.4309 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 75.589 |
| InChI Key: | NTCHGQRWNQZPCL-UHFFFAOYSA-N |