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N-[3-(3,6-dichloro-9H-carbazol-9-yl)-2-hydroxypropyl]-N-(4-methoxyphenyl)-4-methylbenzenesulfonamide

HCID 3129558
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Basic information

CAS
314042-77-8
Standard SMILES
COc1ccc(N(CC(O)Cn2c3ccc(Cl)cc3c3cc(Cl)ccc32)S(=O)(=O)c2ccc(C)cc2)cc1
InChIKey
RAEPSNLFIXDABR-UHFFFAOYSA-N
Molecular formula
C29H26Cl2N2O4S
Average molar mass
569.5 g/mol
Monoisotopic mass
568.0990339

Names & identifiers

Preferred name
N-[3-(3,6-dichloro-9H-carbazol-9-yl)-2-hydroxypropyl]-N-(4-methoxyphenyl)-4-methylbenzenesulfonamide
IUPAC
N-[3-(3,6-dichlorocarbazol-9-yl)-2-hydroxypropyl]-N-(4-methoxyphenyl)-4-methylbenzenesulfonamide
English name
N-[3-(3,6-dichlorocarbazol-9-yl)-2-hydroxypropyl]-N-(4-methoxyphenyl)-4-methylbenzenesulfonamide
Molecular formula
C29H26Cl2N2O4S
Molecular weight
569.5

Names & synonyms

N-[3-(3,6-dichloro-9H-carbazol-9-yl)-2-hydroxypropyl]-N-(4-methoxyphenyl)-4-methylbenzenesulfonamideN-(3-(3,6-dichloro-9H-carbazol-9-yl)-2-hydroxypropyl)-N-(4-methoxyphenyl)-4-methylbenzenesulfonamideChemDiv1_021206Oprea1_234609Oprea1_556551HMS647D20STK836986AKOS000581750AKOS016323905ST50250471SR-01000431696SR-01000431696-1
Show more names
N-[3-(3,6-dichlorocarbazol-9-yl)-2-hydroxypropyl]-N-(4-methoxyphenyl)-4-methylbenzenesulfonamideBenzenesulfonamide, N-[3-(3,6-dichloro-9H-carbazol-9-yl)-2-hydroxypropyl]-N-(4-methoxyphenyl)-4-methyl-
[3-(3,6-dichlorocarbazol-9-yl)-2-hydroxypropyl](4-methoxyphenyl)[(4-methylphen yl)sulfonyl]amine

Database identifiers

Properties

Computed structural properties

XLogP
6.6
Topological polar surface area
80.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
8
Heavy atoms
38
Formal charge
0
Complexity
846

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Compound notes

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CAS
314042-77-8
PubChem CID
3129558
EC Number
122-631-1