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646056-47-5 | 2,7-Diazaspiro[4.4]nonane, 2-(5-isothiazolyl)-
CAS No: 646056-47-5 Catalog No: AG006SPW MDL No:
Product Description
Catalog Number:
AG006SPW
Chemical Name:
2,7-Diazaspiro[4.4]nonane, 2-(5-isothiazolyl)-
CAS Number:
646056-47-5
Molecular Formula:
C10H15N3S
Molecular Weight:
209.3112
IUPAC Name:
5-(2,7-diazaspiro[4.4]nonan-2-yl)-1,2-thiazole
InChI:
InChI=1S/C10H15N3S/c1-4-12-14-9(1)13-6-3-10(8-13)2-5-11-7-10/h1,4,11H,2-3,5-8H2
InChI Key:
YUKHHOUFUDHONZ-UHFFFAOYSA-N
SMILES:
C1NCC2(C1)CCN(C2)c1ccns1
Properties
Complexity:
223
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
209.099g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
209.311g/mol
Monoisotopic Mass:
209.099g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.4A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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