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Home > Pyridines > 1391733-87-1
1391733-87-1 | tert-Butyl 1-(cyclopropylmethyl)-7-(hydroxymethyl)-6,7-dihydro-1h-[1,2,3]triazolo[4,5-c]pyridine-5(4
CAS No: 1391733-87-1 Catalog No: AG00HVGK MDL No:MFCD23378418
Product Description
Catalog Number:
AG00HVGK
Chemical Name:
tert-Butyl 1-(cyclopropylmethyl)-7-(hydroxymethyl)-6,7-dihydro-1h-[1,2,3]triazolo[4,5-c]pyridine-5(4
CAS Number:
1391733-87-1
Molecular Formula:
C15H24N4O3
Molecular Weight:
308.3761
MDL Number:
MFCD23378418
IUPAC Name:
tert-butyl 1-(cyclopropylmethyl)-7-(hydroxymethyl)-6,7-dihydro-4H-triazolo[4,5-c]pyridine-5-carboxylate
InChI:
InChI=1S/C15H24N4O3/c1-15(2,3)22-14(21)18-7-11(9-20)13-12(8-18)16-17-19(13)6-10-4-5-10/h10-11,20H,4-9H2,1-3H3
InChI Key:
HHXHNOLUYVPSCV-UHFFFAOYSA-N
SMILES:
OCC1CN(Cc2c1n(nn2)CC1CC1)C(=O)OC(C)(C)C
Properties
Complexity:
422
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.185g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
308.382g/mol
Monoisotopic Mass:
308.185g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
80.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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