4-{[5-(4-methoxyphenyl)-4-methyl-1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-thiazol-2-yl]methyl}-N-[2-methyl-1-(thiophen-2-yl)propyl]benzamide
Chemical Structure Depiction of
4-{[5-(4-methoxyphenyl)-4-methyl-1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-thiazol-2-yl]methyl}-N-[2-methyl-1-(thiophen-2-yl)propyl]benzamide
4-{[5-(4-methoxyphenyl)-4-methyl-1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-thiazol-2-yl]methyl}-N-[2-methyl-1-(thiophen-2-yl)propyl]benzamide
Compound characteristics
Compound ID: | G206-4221 |
Compound Name: | 4-{[5-(4-methoxyphenyl)-4-methyl-1,1,3-trioxo-1,3-dihydro-2H-1lambda~6~,2-thiazol-2-yl]methyl}-N-[2-methyl-1-(thiophen-2-yl)propyl]benzamide |
Molecular Weight: | 524.66 |
Molecular Formula: | C27 H28 N2 O5 S2 |
Smiles: | CC(C)C(c1cccs1)NC(c1ccc(CN2C(C(C)=C(c3ccc(cc3)OC)S2(=O)=O)=O)cc1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.4205 |
logD: | 4.4205 |
logSw: | -4.1662 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 77.511 |
InChI Key: | KOCCHYCJVFIVPS-DEOSSOPVSA-N |