Tìm theo
Aminodi(Ethyloxy)Ethylaminocarbonylbenzenesulfonamide
Thuốc Gốc
Small Molecule
CTHH: C13H21N3O5S
PTK: 331.388
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
Phân tử khối
331.388
Monoisotopic mass
331.120191487
InChI
InChI=1S/C13H21N3O5S/c14-5-7-20-9-10-21-8-6-16-13(17)11-1-3-12(4-2-11)22(15,18)19/h1-4H,5-10,14H2,(H,16,17)(H2,15,18,19)
InChI Key
InChIKey=QGGYVKRXFQLYQD-UHFFFAOYSA-N
IUPAC Name
N-{2-[2-(2-aminoethoxy)ethoxy]ethyl}-4-sulfamoylbenzamide
Traditional IUPAC Name
N-{2-[2-(2-aminoethoxy)ethoxy]ethyl}-4-sulfamoylbenzamide
SMILES
NCCOCCOCCNC(=O)C1=CC=C(C=C1)S(N)(=O)=O
Độ hòa tan
1.15e+00 g/l
logP
-1.6
logS
-2.5
pKa (strongest acidic)
10.07
pKa (Strongest Basic)
9.33
PSA
133.74 Å2
Refractivity
82.23 m3·mol-1
Polarizability
35.17 Å3
Rotatable Bond Count
10
H Bond Acceptor Count
6
H Bond Donor Count
3
Physiological Charge
1
Number of Rings
1
Bioavailability
1
Rule of Five
true
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