HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

N-(2-(Diethylamino)-5-((octadecylamino)sulphonyl)phenyl)-1-hydroxynaphthalene-2-carboxamide

HCID 3023965
NotesReactions
Basic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
94200-79-0
Standard SMILES
CCCCCCCCCCCCCCCCCCNS(=O)(=O)c1ccc(N(CC)CC)c(NC(=O)c2ccc3ccccc3c2O)c1
InChIKey
NAGPEELNXLWGNH-UHFFFAOYSA-N
Molecular formula
C39H59N3O4S
Average molar mass
666 g/mol
Monoisotopic mass
665.42262855

Names & identifiers

Preferred name
N-(2-(Diethylamino)-5-((octadecylamino)sulphonyl)phenyl)-1-hydroxynaphthalene-2-carboxamide
IUPAC
N-[2-(diethylamino)-5-(octadecylsulfamoyl)phenyl]-1-hydroxynaphthalene-2-carboxamide
English name
N-[2-(diethylamino)-5-[(octadecylamino)sulphonyl]phenyl]-1-hydroxynaphthalene-2-carboxamide
Molecular formula
C39H59N3O4S
Molecular weight
665.96846

Names & synonyms

94200-79-0EINECS 303-559-1KJ04K32UUKUNII-KJ04K32UUKN-(2-(Diethylamino)-5-((octadecylamino)sulphonyl)phenyl)-1-hydroxynaphthalene-2-carboxamideN-[2-(diethylamino)-5-(octadecylsulfamoyl)phenyl]-1-hydroxynaphthalene-2-carboxamideN-(2-(Diethylamino)-5-((octadecylamino)sulfonyl)phenyl)-1-hydroxynaphthalene-2-carboxamideSCHEMBL17817179DTXSID90240998NAGPEELNXLWGNH-UHFFFAOYSA-NSTK379897AKOS003602342
Show more names
N-(2-(DIETHYLAMINO)-5-((OCTADECYLAMINO)SULFONYL)PHENYL)-1-HYDROXY-2-NAPHTHAMIDEN-[2-(Diethylamino)-5-[(octadecylamino)sulfonyl]phenyl]-1-hydroxy-2-naphthalenecarboxamideN-[2-(diethylamino)-5-[(octadecylamino)sulphonyl]phenyl]-1-hydroxynaphthalene-2-carboxamide
NS00040240ST50874715N-{2-(diethylamino)-5-[(octadecylamino)sulfonyl]phenyl}(1-hydroxy(2-naphthyl)) carboxamideN-{2-(diethylamino)-5-[(octadecylamino)sulfonyl]phenyl}-1-hydroxy-2-naphthamide2-NAPHTHALENECARBOXAMIDE, N-(2-(DIETHYLAMINO)-5-((OCTADECYLAMINO)SULFONYL)PHENYL)-1-HYDROXY-

Properties

Computed structural properties

XLogP
12.9
Topological polar surface area
107 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
24
Heavy atoms
47
Formal charge
0
Complexity
937

Physicochemical properties

FDA UNII
4 K32UUK · KJ04K32UUK

Chemistry & industry

Suppliers1 total

西格玛奥德里奇(上海)贸易有限公司21-20338288 · [email protected]

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesChemistry & industryRelated reactionsCompound notes

Database identifiers

CAS
94200-79-0
PubChem CID
3023965
DTXSID
DTXSID90240998
UNII
KJ04K32UUK
EC Number
303-559-1
Nikkaji
J319.121D