2-amino-4-(2,6-dichlorophenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(2,6-dichlorophenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
2-amino-4-(2,6-dichlorophenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile
Compound characteristics
Compound ID: | 8645-0078 |
Compound Name: | 2-amino-4-(2,6-dichlorophenyl)-7-methyl-5-oxo-4H,5H-pyrano[4,3-b]pyran-3-carbonitrile |
Molecular Weight: | 349.17 |
Molecular Formula: | C16 H10 Cl2 N2 O3 |
Smiles: | CC1=CC2=C(C(C(C#N)=C(N)O2)c2c(cccc2[Cl])[Cl])C(=O)O1 |
Stereo: | RACEMIC MIXTURE |
logP: | 2.2365 |
logD: | 2.2365 |
logSw: | -2.997 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 68.889 |
InChI Key: | MYSIOPAOBNTDFR-LBPRGKRZSA-N |