4-anilino-2-(2H-1,3-benzodioxol-5-yl)-N-[3-(morpholin-4-yl)propyl]pyrimidine-5-carboxamide
Chemical Structure Depiction of
4-anilino-2-(2H-1,3-benzodioxol-5-yl)-N-[3-(morpholin-4-yl)propyl]pyrimidine-5-carboxamide
4-anilino-2-(2H-1,3-benzodioxol-5-yl)-N-[3-(morpholin-4-yl)propyl]pyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | V017-8303 |
| Compound Name: | 4-anilino-2-(2H-1,3-benzodioxol-5-yl)-N-[3-(morpholin-4-yl)propyl]pyrimidine-5-carboxamide |
| Molecular Weight: | 461.52 |
| Molecular Formula: | C25 H27 N5 O4 |
| Salt: | not_available |
| Smiles: | C(CNC(c1cnc(c2ccc3c(c2)OCO3)nc1Nc1ccccc1)=O)CN1CCOCC1 |
| Stereo: | ACHIRAL |
| logP: | 3.1178 |
| logD: | 2.7295 |
| logSw: | -3.4947 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.873 |
| InChI Key: | VONHHIFLMMQXJM-UHFFFAOYSA-N |