2-{[3-(4-methoxyphenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-{[3-(4-methoxyphenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
2-{[3-(4-methoxyphenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Compound characteristics
Compound ID: | C916-0251 |
Compound Name: | 2-{[3-(4-methoxyphenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide |
Molecular Weight: | 464.63 |
Molecular Formula: | C26 H32 N4 O2 S |
Smiles: | CC(C)c1ccc(cc1)NC(CSC1C(c2ccc(cc2)OC)=NC2(CCN(C)CC2)N=1)=O |
Stereo: | ACHIRAL |
logP: | 4.1319 |
logD: | 1.6431 |
logSw: | -4.092 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 51.251 |
InChI Key: | AUGVJYXBCZSCJM-UHFFFAOYSA-N |