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Home > Pyridines > 1391733-79-1
1391733-79-1 | 2-(5-(tert-Butoxycarbonyl)-2-(cyclopropylmethyl)-4,5,6,7-tetrahydro-2h-pyrazolo[4,3-c]pyridin-7-yl)a
CAS No: 1391733-79-1 Catalog No: AG00HVGF MDL No:MFCD23378366
Product Description
Catalog Number:
AG00HVGF
Chemical Name:
2-(5-(tert-Butoxycarbonyl)-2-(cyclopropylmethyl)-4,5,6,7-tetrahydro-2h-pyrazolo[4,3-c]pyridin-7-yl)a
CAS Number:
1391733-79-1
Molecular Formula:
C17H25N3O4
Molecular Weight:
335.3981
MDL Number:
MFCD23378366
IUPAC Name:
2-[2-(cyclopropylmethyl)-5-[(2-methylpropan-2-yl)oxycarbonyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-7-yl]acetic acid
InChI:
InChI=1S/C17H25N3O4/c1-17(2,3)24-16(23)19-8-12(6-14(21)22)15-13(9-19)10-20(18-15)7-11-4-5-11/h10-12H,4-9H2,1-3H3,(H,21,22)
InChI Key:
YOKYTTPSAYTRPX-UHFFFAOYSA-N
SMILES:
OC(=O)CC1CN(Cc2c1nn(c2)CC1CC1)C(=O)OC(C)(C)C
Properties
Complexity:
501
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
335.185g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
335.404g/mol
Monoisotopic Mass:
335.185g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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