Tìm theo
3,8,9,10-Tetrahydroxy-7-Hydroxymethyl-6-Oxa-1,3-Diaza-Spiro[4.5]Decane-2,4-Dione
Thuốc Gốc
Small Molecule
CTHH: C8H12N2O8
PTK: 264.1895
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
Phân tử khối
264.1895
Monoisotopic mass
264.05936537
InChI
InChI=1S/C8H12N2O8/c11-1-2-3(12)4(13)5(14)8(18-2)6(15)10(17)7(16)9-8/h2-5,11-14,17H,1H2,(H,9,16)/t2-,3-,4+,5-,8-/m1/s1
InChI Key
InChIKey=IHDZZZHACPJCFJ-UXDJRKLDSA-N
IUPAC Name
(5R,7R,8S,9S,10R)-3,8,9,10-tetrahydroxy-7-(hydroxymethyl)-6-oxa-1,3-diazaspiro[4.5]decane-2,4-dione
Traditional IUPAC Name
(5R,7R,8S,9S,10R)-3,8,9,10-tetrahydroxy-7-(hydroxymethyl)-6-oxa-1,3-diazaspiro[4.5]decane-2,4-dione
SMILES
OC[C@H]1O[C@]2(NC(=O)N(O)C2=O)[C@H](O)[C@@H](O)[C@@H]1O
Độ hòa tan
2.62e+02 g/l
logP
-3.3
pKa (strongest acidic)
7.31
pKa (Strongest Basic)
-3
PSA
159.79 Å2
Refractivity
50.73 m3·mol-1
Polarizability
22.32 Å3
logS
0
Rotatable Bond Count
1
H Bond Acceptor Count
8
H Bond Donor Count
6
Physiological Charge
0
Number of Rings
2
Bioavailability
1
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