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138384-97-1 | METHYL 4-((4-(TERT-BUTOXYCARBONYL)PIPERAZINYL)SULFONYL)BENZOATE
CAS No: 138384-97-1 Catalog No: AG01FPEX MDL No:MFCD09038667
Product Description
Catalog Number:
AG01FPEX
Chemical Name:
METHYL 4-((4-(TERT-BUTOXYCARBONYL)PIPERAZINYL)SULFONYL)BENZOATE
CAS Number:
138384-97-1
MDL Number:
MFCD09038667
IUPAC Name:
tert-butyl 4-(4-methoxycarbonylphenyl)sulfonylpiperazine-1-carboxylate
InChI:
InChI=1S/C17H24N2O6S/c1-17(2,3)25-16(21)18-9-11-19(12-10-18)26(22,23)14-7-5-13(6-8-14)15(20)24-4/h5-8H,9-12H2,1-4H3
InChI Key:
JEFLDVXIWBKZRU-UHFFFAOYSA-N
Properties
Complexity:
606
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
384.136g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
384.447g/mol
Monoisotopic Mass:
384.136g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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