3-[(4-butylanilino)methyl]-5-{[4-(diethylamino)phenyl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-[(4-butylanilino)methyl]-5-{[4-(diethylamino)phenyl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
3-[(4-butylanilino)methyl]-5-{[4-(diethylamino)phenyl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
Compound ID: | 2141-0316 |
Compound Name: | 3-[(4-butylanilino)methyl]-5-{[4-(diethylamino)phenyl]methylidene}-2-sulfanylidene-1,3-thiazolidin-4-one |
Molecular Weight: | 453.67 |
Molecular Formula: | C25 H31 N3 O S2 |
Smiles: | CCCCc1ccc(cc1)NCN1C(/C(=C\c2ccc(cc2)N(CC)CC)SC1=S)=O |
Stereo: | ACHIRAL |
logP: | 7.0486 |
logD: | 7.0469 |
logSw: | -5.6661 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 30.3383 |
InChI Key: | KAULEWWLSXUQPY-UHFFFAOYSA-N |