Tìm theo
[3-(Dodecanoylamino)Propyl](Hydroxy)Dimethylammonium
Thuốc Gốc
Small Molecule
CTHH: C17H36N2O2
PTK: 300.4799
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
Phân tử khối
300.4799
Monoisotopic mass
300.277678406
InChI
InChI=1S/C17H36N2O2/c1-4-5-6-7-8-9-10-11-12-14-17(20)18-15-13-16-19(2,3)21/h4-16H2,1-3H3,(H,18,20)
InChI Key
InChIKey=JNGWKQJZIUZUPR-UHFFFAOYSA-N
IUPAC Name
N-[3-(dimethyl-oxo-$l^{5}-azanyl)propyl]dodecanamide
Traditional IUPAC Name
N-[3-(dimethyl-oxo-$l^{5}-azanyl)propyl]dodecanamide
SMILES
CCCCCCCCCCCC(=O)NCCC[N+](C)(C)[O-]
Độ hòa tan
1.90e-03 g/l
logP
2.85
logS
-5.2
pKa (strongest acidic)
15.85
pKa (Strongest Basic)
4.13
PSA
55.98 Å2
Refractivity
90.33 m3·mol-1
Polarizability
39.14 Å3
Rotatable Bond Count
14
H Bond Acceptor Count
2
H Bond Donor Count
1
Physiological Charge
0
Number of Rings
0
Bioavailability
1
Rule of Five
true
Ghose Filter
true
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