Home Aminos 2-(4-(((2,4-Diaminopteridin-6-yl)methyl)amino)benzamido)pentanedioic acid

2-(4-(((2,4-Diaminopteridin-6-yl)methyl)amino)benzamido)pentanedioic acid

CAS No.:
54-62-6
Catalog Number:
AG00I9N1
Molecular Formula:
C19H20N8O5
Molecular Weight:
440.4127
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
10mg
≥95%
1 week
United States
$91
- +
25mg
≥95%
1 week
United States
$122
- +
50mg
≥95%
1 week
United States
$144
- +
Product Description
Catalog Number:
AG00I9N1
Chemical Name:
2-(4-(((2,4-Diaminopteridin-6-yl)methyl)amino)benzamido)pentanedioic acid
CAS Number:
54-62-6
Molecular Formula:
C19H20N8O5
Molecular Weight:
440.4127
MDL Number:
MFCD00150465
IUPAC Name:
(2S)-2-[[4-[(2,4-diaminopteridin-6-yl)methylamino]benzoyl]amino]pentanedioic acid
InChI:
InChI=1S/C19H20N8O5/c20-15-14-16(27-19(21)26-15)23-8-11(24-14)7-22-10-3-1-9(2-4-10)17(30)25-12(18(31)32)5-6-13(28)29/h1-4,8,12,22H,5-7H2,(H,25,30)(H,28,29)(H,31,32)(H4,20,21,23,26,27)/t12-/m0/s1
InChI Key:
TVZGACDUOSZQKY-LBPRGKRZSA-N
SMILES:
OC(=O)CCC(C(=O)O)NC(=O)c1ccc(cc1)NCc1cnc2c(n1)c(N)nc(n2)N
EC Number:
200-209-9
UNII:
JYB41CTM2Q
Properties
Complexity:
674  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
440.156g/mol
Formal Charge:
0
Heavy Atom Count:
32  
Hydrogen Bond Acceptor Count:
12  
Hydrogen Bond Donor Count:
6  
Isotope Atom Count:
0
Molecular Weight:
440.42g/mol
Monoisotopic Mass:
440.156g/mol
Rotatable Bond Count:
9  
Topological Polar Surface Area:
219A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-2  
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Properties