6-amino-4-{4-[(1H-benzimidazol-1-yl)methyl]-5-methylthiophen-2-yl}-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-4-{4-[(1H-benzimidazol-1-yl)methyl]-5-methylthiophen-2-yl}-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-{4-[(1H-benzimidazol-1-yl)methyl]-5-methylthiophen-2-yl}-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
| Compound ID: | 8017-7715 |
| Compound Name: | 6-amino-4-{4-[(1H-benzimidazol-1-yl)methyl]-5-methylthiophen-2-yl}-3-methyl-2,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
| Molecular Weight: | 402.48 |
| Molecular Formula: | C21 H18 N6 O S |
| Smiles: | Cc1c2C(C(C#N)=C(N)Oc2n[nH]1)c1cc(Cn2cnc3ccccc23)c(C)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1136 |
| logD: | 3.0962 |
| logSw: | -3.2901 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 81.754 |
| InChI Key: | AFWMHJATAAEKRN-IBGZPJMESA-N |