6-amino-3-(2H-1,3-benzodioxol-5-yl)-4-(3-hydroxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-3-(2H-1,3-benzodioxol-5-yl)-4-(3-hydroxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-3-(2H-1,3-benzodioxol-5-yl)-4-(3-hydroxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
| Compound ID: | 4333-4146 |
| Compound Name: | 6-amino-3-(2H-1,3-benzodioxol-5-yl)-4-(3-hydroxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
| Molecular Weight: | 374.35 |
| Molecular Formula: | C20 H14 N4 O4 |
| Smiles: | C1Oc2ccc(cc2O1)c1c2C(C(C#N)=C(N)Oc2[nH]n1)c1cccc(c1)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4987 |
| logD: | 2.4949 |
| logSw: | -2.5254 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 105.206 |
| InChI Key: | XFRMYHQHDHNOSX-MRXNPFEDSA-N |