XIPAMIDE

Search structure
Synonyms:
Status: Approved
Entry Type: Small molecule
Molecule Category: Parent
ATC: C03BA10
UNII: 4S9EY0NUEC

Structure
InChI Key MTZBBNMLMNBNJL-UHFFFAOYSA-N
Smile Cc1cccc(C)c1NC(=O)c1cc(S(N)(=O)=O)c(Cl)cc1O
InChI
InChI=1S/C15H15ClN2O4S/c1-8-4-3-5-9(2)14(8)18-15(20)10-6-13(23(17,21)22)11(16)7-12(10)19/h3-7,19H,1-2H3,(H,18,20)(H2,17,21,22)

Physicochemical Descriptors

Property Name Value
Molecular Formula C15H15ClN2O4S
Molecular Weight 354.82
AlogP 2.56
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 3.0
Polar Surface Area 109.49
Molecular species ACID
Aromatic Rings 2.0
Heavy Atoms 23.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 135499
ChEMBL CHEMBL517199
DrugBank DB13803
DrugCentral 2853
EPA CompTox DTXSID5023744
FDA SRS 4S9EY0NUEC
Guide to Pharmacology 7900
PubChem 26618
SureChEMBL SCHEMBL43532
ZINC ZINC000000538538
CONTENTS