Tìm theo
4-(Aminosulfonyl)-N-[(2,5-Difluorophenyl)Methyl]-Benzamide
Thuốc Gốc
Small Molecule
CTHH: C14H12F2N2O3S
PTK: 326.318
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
Phân tử khối
326.318
Monoisotopic mass
326.05366936
InChI
InChI=1S/C14H12F2N2O3S/c15-11-3-6-13(16)10(7-11)8-18-14(19)9-1-4-12(5-2-9)22(17,20)21/h1-7H,8H2,(H,18,19)(H2,17,20,21)
InChI Key
InChIKey=KEGUALXMKQVDIO-UHFFFAOYSA-N
IUPAC Name
N-[(2,5-difluorophenyl)methyl]-4-sulfamoylbenzamide
Traditional IUPAC Name
N-[(2,5-difluorophenyl)methyl]-4-sulfamoylbenzamide
SMILES
NS(=O)(=O)C1=CC=C(C=C1)C(=O)NCC1=CC(F)=CC=C1F
Độ hòa tan
1.98e-02 g/l
logP
1.66
logS
-4.2
pKa (strongest acidic)
9.95
pKa (Strongest Basic)
-1.3
PSA
89.26 Å2
Refractivity
77.24 m3·mol-1
Polarizability
29.94 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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