Home Sulfos N-(cyclopropylmethyl)-4-[(cyclopropylmethyl)amino]-2-nitrobenzene-1-sulfonamide

N-(cyclopropylmethyl)-4-[(cyclopropylmethyl)amino]-2-nitrobenzene-1-sulfonamide

CAS No.:
1221726-11-9
Catalog Number:
AG01A7K8
Molecular Formula:
C14H19N3O4S
Molecular Weight:
325.3834
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Product Description
Catalog Number:
AG01A7K8
Chemical Name:
N-(cyclopropylmethyl)-4-[(cyclopropylmethyl)amino]-2-nitrobenzene-1-sulfonamide
CAS Number:
1221726-11-9
Molecular Formula:
C14H19N3O4S
Molecular Weight:
325.3834
MDL Number:
MFCD14705712
IUPAC Name:
N-(cyclopropylmethyl)-4-(cyclopropylmethylamino)-2-nitrobenzenesulfonamide
InChI:
InChI=1S/C14H19N3O4S/c18-17(19)13-7-12(15-8-10-1-2-10)5-6-14(13)22(20,21)16-9-11-3-4-11/h5-7,10-11,15-16H,1-4,8-9H2
InChI Key:
LZDOFPCPLHYCHV-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(NCC2CC2)ccc1S(=O)(=O)NCC1CC1
Properties
Complexity:
505  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.11g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
325.383g/mol
Monoisotopic Mass:
325.11g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties