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606082-40-0 | Benzothiazole, 2-[1-[[1-(1,1-dimethylpropyl)-1H-tetrazol-5-yl]methyl]-4-piperidinyl]- (9CI)
CAS No: 606082-40-0 Catalog No: AG00EOF1 MDL No:
Product Description
Catalog Number:
AG00EOF1
Chemical Name:
Benzothiazole, 2-[1-[[1-(1,1-dimethylpropyl)-1H-tetrazol-5-yl]methyl]-4-piperidinyl]- (9CI)
CAS Number:
606082-40-0
IUPAC Name:
2-[1-[[1-(2-methylbutan-2-yl)tetrazol-5-yl]methyl]piperidin-4-yl]-1,3-benzothiazole
InChI:
InChI=1S/C19H26N6S/c1-4-19(2,3)25-17(21-22-23-25)13-24-11-9-14(10-12-24)18-20-15-7-5-6-8-16(15)26-18/h5-8,14H,4,9-13H2,1-3H3
InChI Key:
FWPSQNFKCOMWAO-UHFFFAOYSA-N
Properties
Complexity:
467
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
370.194g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
370.519g/mol
Monoisotopic Mass:
370.194g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
88A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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