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89443-70-9 | 1H-Indazol-5-ol, 3-[[3-(4-chloro-1-piperidinyl)propyl]amino]-
CAS No: 89443-70-9 Catalog No: AG0043F9 MDL No:
Product Description
Catalog Number:
AG0043F9
Chemical Name:
1H-Indazol-5-ol, 3-[[3-(4-chloro-1-piperidinyl)propyl]amino]-
CAS Number:
89443-70-9
Molecular Formula:
C15H21ClN4O
Molecular Weight:
308.8064
IUPAC Name:
3-[3-(4-chloropiperidin-1-yl)propylamino]-1H-indazol-5-ol
InChI:
InChI=1S/C15H21ClN4O/c16-11-4-8-20(9-5-11)7-1-6-17-15-13-10-12(21)2-3-14(13)18-19-15/h2-3,10-11,21H,1,4-9H2,(H2,17,18,19)
InChI Key:
LJRWTDCVKIPLCV-UHFFFAOYSA-N
SMILES:
ClC1CCN(CC1)CCCNc1n[nH]c2c1cc(O)cc2
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.14g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
308.81g/mol
Monoisotopic Mass:
308.14g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
64.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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