2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-[3-(diethylamino)propyl]-4-methylpyrimidine-5-carboxamide
Chemical Structure Depiction of
2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-[3-(diethylamino)propyl]-4-methylpyrimidine-5-carboxamide
2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-[3-(diethylamino)propyl]-4-methylpyrimidine-5-carboxamide
Compound characteristics
| Compound ID: | G415-4573 |
| Compound Name: | 2-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-N-[3-(diethylamino)propyl]-4-methylpyrimidine-5-carboxamide |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C21 H29 N5 O3 |
| Smiles: | CCN(CC)CCCNC(c1cnc(NCc2ccc3c(c2)OCO3)nc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3124 |
| logD: | -0.4086 |
| logSw: | -2.8643 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.33 |
| InChI Key: | RQRNGAAUCPTJNZ-UHFFFAOYSA-N |