3,6-diamino-2-(4-chlorobenzoyl)-4-(4-ethoxyphenyl)thieno[2,3-b]pyridine-5-carbonitrile
Chemical Structure Depiction of
3,6-diamino-2-(4-chlorobenzoyl)-4-(4-ethoxyphenyl)thieno[2,3-b]pyridine-5-carbonitrile
3,6-diamino-2-(4-chlorobenzoyl)-4-(4-ethoxyphenyl)thieno[2,3-b]pyridine-5-carbonitrile
Compound characteristics
Compound ID: | 8009-7619 |
Compound Name: | 3,6-diamino-2-(4-chlorobenzoyl)-4-(4-ethoxyphenyl)thieno[2,3-b]pyridine-5-carbonitrile |
Molecular Weight: | 448.93 |
Molecular Formula: | C23 H17 Cl N4 O2 S |
Smiles: | CCOc1ccc(cc1)c1c(C#N)c(N)nc2c1c(c(C(c1ccc(cc1)[Cl])=O)s2)N |
Stereo: | ACHIRAL |
logP: | 5.369 |
logD: | 5.369 |
logSw: | -6.1562 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 4 |
Polar surface area: | 87.417 |
InChI Key: | DYUCKKSVBIIINK-UHFFFAOYSA-N |