Tìm theo
4-(Aminosulfonyl)-N-[(2,4,6-Trifluorophenyl)Methyl]-Benzamide
Thuốc Gốc
Small Molecule
CTHH: C14H11F3N2O3S
PTK: 344.309
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
Phân tử khối
344.309
Monoisotopic mass
344.044247533
InChI
InChI=1S/C14H11F3N2O3S/c15-9-5-12(16)11(13(17)6-9)7-19-14(20)8-1-3-10(4-2-8)23(18,21)22/h1-6H,7H2,(H,19,20)(H2,18,21,22)
InChI Key
InChIKey=DVTYOTODFLDHRL-UHFFFAOYSA-N
IUPAC Name
4-sulfamoyl-N-[(2,4,6-trifluorophenyl)methyl]benzamide
Traditional IUPAC Name
4-sulfamoyl-N-[(2,4,6-trifluorophenyl)methyl]benzamide
SMILES
NS(=O)(=O)C1=CC=C(C=C1)C(=O)NCC1=C(F)C=C(F)C=C1F
Độ hòa tan
1.23e-02 g/l
logP
1.81
logS
-4.5
pKa (strongest acidic)
9.95
pKa (Strongest Basic)
-1.3
PSA
89.26 Å2
Refractivity
77.45 m3·mol-1
Polarizability
30.04 Å3
Rotatable Bond Count
4
H Bond Acceptor Count
3
H Bond Donor Count
2
Physiological Charge
0
Number of Rings
2
Bioavailability
1
Rule of Five
true
Ghose Filter
true
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