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

Chemical Structure Depiction of
2-[(3-ethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-[4-(trifluoromethyl)phenyl]acetamide
Available: 182 mg
Amount:
mg
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Compound characteristics

Compound ID: G864-0045
Compound Name: 2-[(3-ethyl-4-oxo-4,5-dihydro-3H-pyrimido[5,4-b]indol-2-yl)sulfanyl]-N-[4-(trifluoromethyl)phenyl]acetamide
Molecular Weight: 446.45
Molecular Formula: C21 H17 F3 N4 O2 S
Smiles: CCN1C(=Nc2c3ccccc3[nH]c2C1=O)SCC(Nc1ccc(cc1)C(F)(F)F)=O
Stereo: ACHIRAL
logP: 4.1592
logD: 4.1592
logSw: -4.1663
Hydrogen bond acceptors count: 6
Hydrogen bond donors count: 2
Polar surface area: 56.875
InChI Key: YTVZJRYMFBBNSO-UHFFFAOYSA-N
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