CAS 4108-89-8 | 1H-Azepine-1-sulfonamide,hexahydro-(7CI,8CI,9CI) | CAS Number 4108-89-8

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4108-89-8 | 1H-Azepine-1-sulfonamide,hexahydro-(7CI,8CI,9CI)

CAS No: 4108-89-8 Catalog No: AG00CWPH MDL No:MFCD03078356

Product Description

Catalog Number:

AG00CWPH

Chemical Name:

1H-Azepine-1-sulfonamide,hexahydro-(7CI,8CI,9CI)

CAS Number:

4108-89-8

Molecular Formula:

C6H14N2O2S

Molecular Weight:

178.2526

MDL Number:

MFCD03078356

IUPAC Name:

azepane-1-sulfonamide

InChI:

InChI=1S/C6H14N2O2S/c7-11(9,10)8-5-3-1-2-4-6-8/h1-6H2,(H2,7,9,10)

InChI Key:

GOWDFSKVUJAHJJ-UHFFFAOYSA-N

SMILES:

NS(=O)(=O)N1CCCCCC1

Properties

Complexity:

199

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

178.078g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

178.25g/mol

Monoisotopic Mass:

178.078g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71.8A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

Literature

Title	Journal
Carbonic anhydrase inhibitors: inhibition of cytosolic isozymes I and II with sulfamide derivatives.	Bioorganic & medicinal chemistry letters 20030310
Anti-convulsant effect of phthalazino-2,3b-phthalazine-5(14H),12(7h)-dione (L-5418). I. Behavioral effect.	Japanese journal of pharmacology 19780201