N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(3-ethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide

Chemical Structure Depiction of
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(3-ethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide
Available: 213 mg
Amount:
mg
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Compound characteristics

Compound ID: G864-0080
Compound Name: N-[2-chloro-5-(trifluoromethyl)phenyl]-2-[(3-ethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]acetamide
Molecular Weight: 480.89
Molecular Formula: C21 H16 Cl F3 N4 O2 S
Smiles: CCN1C(=Nc2c3ccccc3[nH]c2C1=O)SCC(Nc1cc(ccc1[Cl])C(F)(F)F)=O
Stereo: ACHIRAL
logP: 4.5114
logD: 4.4916
logSw: -4.6191
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 2
Polar surface area: 56.177
InChI Key: RMENPZFUVFZGKG-UHFFFAOYSA-N
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