2-amino-7-hydroxy-4-(2,3,4-trimethoxyphenyl)-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-7-hydroxy-4-(2,3,4-trimethoxyphenyl)-4H-1-benzopyran-3-carbonitrile
2-amino-7-hydroxy-4-(2,3,4-trimethoxyphenyl)-4H-1-benzopyran-3-carbonitrile
Compound characteristics
Compound ID: | 8020-6710 |
Compound Name: | 2-amino-7-hydroxy-4-(2,3,4-trimethoxyphenyl)-4H-1-benzopyran-3-carbonitrile |
Molecular Weight: | 354.36 |
Molecular Formula: | C19 H18 N2 O5 |
Smiles: | COc1ccc(C2C(C#N)=C(N)Oc3cc(ccc23)O)c(c1OC)OC |
Stereo: | RACEMIC MIXTURE |
logP: | 2.2373 |
logD: | 2.237 |
logSw: | -2.6466 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 86.975 |
InChI Key: | XWVURMSTWFAOJY-MRXNPFEDSA-N |