N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[2-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino}benzamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[2-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino}benzamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[2-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino}benzamide
Compound characteristics
| Compound ID: | D401-0190 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-4-{[2-(4-methoxyphenyl)imidazo[1,2-a]pyrazin-3-yl]amino}benzamide |
| Molecular Weight: | 493.52 |
| Molecular Formula: | C28 H23 N5 O4 |
| Smiles: | COc1ccc(cc1)c1c(Nc2ccc(cc2)C(NCc2ccc3c(c2)OCO3)=O)n2ccncc2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.017 |
| logD: | 4.0167 |
| logSw: | -4.0341 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.269 |
| InChI Key: | MFRLYWIBYDHWMT-UHFFFAOYSA-N |