Text Search
Structure Search

N-[4-(dibutylsulfamoyl)phenyl]-4-methoxy-3-nitrobenzamide

N-[4-(dibutylsulfamoyl)phenyl]-4-methoxy-3-nitrobenzamide

Formula: C22H29N3O6S

SMILES: CCCCN(CCCC)S(=O)(=O)C1=CC=C(NC(=O)C2=CC=C(OC)C(=C2)[N+]([O-])=O)C=C1

IUPAC: N-[4-(dibutylsulfamoyl)phenyl]-4-methoxy-3-nitrobenzamide

InChI: InChI=1S/C22H29N3O6S/c1-4-6-14-24(15-7-5-2)32(29,30)19-11-9-18(10-12-19)23-22(26)17-8-13-21(31-3)20(16-17)25(27)28/h8-13,16H,4-7,14-15H2,1-3H3,(H,23,26)

Composition: C (57.00%), H (6.31%), N (9.07%), O (20.71%), S (6.92%)

Molar Mass: 463.55

Atom Count: 61

Heavy Atom Count: 32

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 463.17770684
Formal Charge 0
FSP3 0.41
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 1
InChIKey LAKBYFQQXLLZNN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 124.07
Topological Polar Surface Area 118.85
Polarizability 47.37
Ring Count 2
Rotatable Bond Count 11

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
| Clear Filters
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C22H29N3O6S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
Request Quote