3-amino-N-(4-chlorophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Chemical Structure Depiction of
3-amino-N-(4-chlorophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
3-amino-N-(4-chlorophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide
Compound characteristics
Compound ID: | 4296-0880 |
Compound Name: | 3-amino-N-(4-chlorophenyl)-7,7-dimethyl-5-oxo-5,6,7,8-tetrahydrothieno[2,3-b]quinoline-2-carboxamide |
Molecular Weight: | 399.9 |
Molecular Formula: | C20 H18 Cl N3 O2 S |
Smiles: | CC1(C)CC(c2cc3c(c(C(Nc4ccc(cc4)[Cl])=O)sc3nc2C1)N)=O |
Stereo: | ACHIRAL |
logP: | 4.4139 |
logD: | 4.4136 |
logSw: | -4.695 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 3 |
Polar surface area: | 67.106 |
InChI Key: | IPCPKYPXYRGGCE-UHFFFAOYSA-N |