Home Sulfos tert-butyl N-[2-[(4-aminophenyl)sulfonylamino]ethyl]carbamate

tert-butyl N-[2-[(4-aminophenyl)sulfonylamino]ethyl]carbamate

CAS No.:
902775-91-1
Catalog Number:
AG00IG2E
Molecular Formula:
C13H21N3O4S
Molecular Weight:
315.3885
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Product Description
Catalog Number:
AG00IG2E
Chemical Name:
tert-butyl N-[2-[(4-aminophenyl)sulfonylamino]ethyl]carbamate
CAS Number:
902775-91-1
Molecular Formula:
C13H21N3O4S
Molecular Weight:
315.3885
MDL Number:
MFCD13196060
IUPAC Name:
tert-butyl N-[2-[(4-aminophenyl)sulfonylamino]ethyl]carbamate
InChI:
InChI=1S/C13H21N3O4S/c1-13(2,3)20-12(17)15-8-9-16-21(18,19)11-6-4-10(14)5-7-11/h4-7,16H,8-9,14H2,1-3H3,(H,15,17)
InChI Key:
RTNTUKJYLWHQSP-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)NCCNS(=O)(=O)c1ccc(cc1)N
Properties
Complexity:
431  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
315.125g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
315.388g/mol
Monoisotopic Mass:
315.125g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Properties