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N-[2-(cyclohexylcarbamoyl)phenyl]-4-(N-methylbenzenesulfonamido)benzamide

N-[2-(cyclohexylcarbamoyl)phenyl]-4-(N-methylbenzenesulfonamido)benzamide

Formula: C27H29N3O4S

SMILES: CN(C1=CC=C(C=C1)C(=O)NC1=CC=CC=C1C(=O)NC1CCCCC1)S(=O)(=O)C1=CC=CC=C1

IUPAC: N-[2-(cyclohexylcarbamoyl)phenyl]-4-(N-methylbenzenesulfonamido)benzamide

InChI: InChI=1S/C27H29N3O4S/c1-30(35(33,34)23-12-6-3-7-13-23)22-18-16-20(17-19-22)26(31)29-25-15-9-8-14-24(25)27(32)28-21-10-4-2-5-11-21/h3,6-9,12-19,21H,2,4-5,10-11H2,1H3,(H,28,32)(H,29,31)

Composition: C (65.97%), H (5.95%), N (8.55%), O (13.02%), S (6.52%)

Molar Mass: 491.61

Atom Count: 64

Heavy Atom Count: 35

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 491.1878776
Formal Charge 0
FSP3 0.26
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 2
InChIKey IILFAVIWDPHVSL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 138.31
Topological Polar Surface Area 95.58
Polarizability 52.79
Ring Count 4
Rotatable Bond Count 6

Suppliers

Purity (%)
-
Ships Within
Days
Packet Size
Molecule Market Select
Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C27H29N3O4S $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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