Tìm theo
2-CHLORO-4-ISOPROPYLAMINO-6-ETHYLAMINO -1,3,5-TRIAZINE
Thuốc Gốc
Small Molecule
CTHH: C8H14ClN5
PTK: 215.683
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
Phân tử khối
215.683
Monoisotopic mass
215.09377318
InChI
InChI=1S/C8H14ClN5/c1-4-10-7-12-6(9)13-8(14-7)11-5(2)3/h5H,4H2,1-3H3,(H2,10,11,12,13,14)
InChI Key
InChIKey=MXWJVTOOROXGIU-UHFFFAOYSA-N
IUPAC Name
6-chloro-2-N-ethyl-4-N-(propan-2-yl)-1,3,5-triazine-2,4-diamine
Traditional IUPAC Name
atrazine
SMILES
CCNC1=NC(NC(C)C)=NC(Cl)=N1
Độ hòa tan
2.75e-02 g/l
logP
2.2
logS
-3.9
pKa (strongest acidic)
14.48
pKa (Strongest Basic)
3.2
PSA
62.73 Å2
Refractivity
62.22 m3·mol-1
Polarizability
22.59 Å3
Rotatable Bond Count
4
H Bond Acceptor Count
5
H Bond Donor Count
2
Physiological Charge
0
Number of Rings
1
Bioavailability
1
Rule of Five
true
Ghose Filter
true
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