Tìm theo
N-[1-(4-Bromophenyl)Ethyl]-5-Fluoro Salicylamide
Thuốc Gốc
Small Molecule
CTHH: C15H13BrFNO2
PTK: 338.172
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C15H13BrFNO2
Phân tử khối
338.172
Monoisotopic mass
337.011369517
InChI
InChI=1S/C15H13BrFNO2/c1-9(10-2-4-11(16)5-3-10)18-15(20)13-8-12(17)6-7-14(13)19/h2-9,19H,1H3,(H,18,20)/t9-/m0/s1
InChI Key
InChIKey=KFTNEILVDDUXGR-VIFPVBQESA-N
IUPAC Name
N-[(1S)-1-(4-bromophenyl)ethyl]-5-fluoro-2-hydroxybenzamide
Traditional IUPAC Name
N-[(1S)-1-(4-bromophenyl)ethyl]-5-fluoro-2-hydroxybenzamide
SMILES
C[C@H](NC(=O)C1=CC(F)=CC=C1O)C1=CC=C(Br)C=C1
Độ hòa tan
1.06e-02 g/l
logP
4.45
logS
-4.5
pKa (strongest acidic)
7.93
pKa (Strongest Basic)
-1.6
PSA
49.33 Å2
Refractivity
78.88 m3·mol-1
Polarizability
29.12 Å3
Rotatable Bond Count
3
H Bond Acceptor Count
2
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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