Tìm theo
(3R)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-1-amine
Thuốc Gốc
Small Molecule
CTHH: C17H18F3NO
PTK: 309.3261
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
Phân tử khối
309.3261
Monoisotopic mass
309.134048818
InChI
InChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3/t16-/m1/s1
InChI Key
InChIKey=RTHCYVBBDHJXIQ-MRXNPFEDSA-N
IUPAC Name
methyl[(3R)-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amine
Traditional IUPAC Name
methyl[(3R)-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propyl]amine
SMILES
[H][C@](CCNC)(OC1=CC=C(C=C1)C(F)(F)F)C1=CC=CC=C1
Độ hòa tan
1.70e-03 g/l
logP
4.17
logS
-5.3
pKa (Strongest Basic)
9.8
PSA
21.26 Å2
Refractivity
80.37 m3·mol-1
Polarizability
30.32 Å3
Rotatable Bond Count
7
H Bond Acceptor Count
2
H Bond Donor Count
1
Physiological Charge
1
Number of Rings
2
Bioavailability
1
Rule of Five
true
Ghose Filter
true
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