6-amino-4-{2-[(4-bromophenyl)methoxy]-3-methoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Chemical Structure Depiction of
6-amino-4-{2-[(4-bromophenyl)methoxy]-3-methoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
6-amino-4-{2-[(4-bromophenyl)methoxy]-3-methoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
Compound characteristics
Compound ID: | 4303-0801 |
Compound Name: | 6-amino-4-{2-[(4-bromophenyl)methoxy]-3-methoxyphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile |
Molecular Weight: | 467.32 |
Molecular Formula: | C22 H19 Br N4 O3 |
Smiles: | Cc1c2C(C(C#N)=C(N)Oc2[nH]n1)c1cccc(c1OCc1ccc(cc1)[Br])OC |
Stereo: | RACEMIC MIXTURE |
logP: | 3.7969 |
logD: | 3.7969 |
logSw: | -4.43 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 85.582 |
InChI Key: | NCTVPXVCWWGHJA-IBGZPJMESA-N |