Cay10595

CAS

916047-16-0

Catalog Number

ACM916047160

Category

Other Products

Molecular Weight

451.232023 [g/mol]

Molecular Formula

C₂₀H₁₃Cl₂FN₂O₅

MSDS COA Spec Sheet

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Specification

Synonyms

CAY10595, 916047-16-0, AGN-PC-00QB8R, SureCN2483463, Spiro-indolinone analogue, 71, CHEMBL258965, CTK8F0801, MolPort-009-019-539, 2-[5-chloro-1-[(5-chloro-2-fluorophenyl)methyl]-2,2,5-trioxospiro[indole-3,3-pyrrolidine]-1-yl]acetic acid

IUPAC Name

2-[5-chloro-1-[(5-chloro-2-fluorophenyl)methyl]-2,2,5-trioxospiro[indole-3,3-pyrrolidine]-1-yl]acetic acid

InChI Key

IXKFWNVFUXXEFY-UHFFFAOYSA-N

Exact Mass

450.01900

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of CAY10595?

The molecular formula of CAY10595 is C20H13Cl2FN2O5.

What is the molecular weight of CAY10595?

The molecular weight of CAY10595 is 451.2 g/mol.

What is the IUPAC name of CAY10595?

The IUPAC name of CAY10595 is 2-[5-chloro-1'-[(5-chloro-2-fluorophenyl)methyl]-2,2',5'-trioxospiro[indole-3,3'-pyrrolidine]-1-yl]acetic acid.

What is the InChI of CAY10595?

The InChI of CAY10595 is InChI=1S/C20H13Cl2FN2O5/c21-11-1-3-14(23)10(5-11)8-25-16(26)7-20(19(25)30)13-6-12(22)2-4-15(13)24(18(20)29)9-17(27)28/h1-6H,7-9H2,(H,27,28).

What is the InChIKey of CAY10595?

The InChIKey of CAY10595 is IXKFWNVFUXXEFY-UHFFFAOYSA-N.

What is the canonical SMILES of CAY10595?

The canonical SMILES of CAY10595 is C1C(=O)N(C(=O)C12C3=C(C=CC(=C3)Cl)N(C2=O)CC(=O)O)CC4=C(C=CC(=C4)Cl)F.

What is the CAS number of CAY10595?

The CAS number of CAY10595 is 916047-16-0.

What is the ChEMBL ID of CAY10595?

The ChEMBL ID of CAY10595 is CHEMBL258965.

How many hydrogen bond donor count does CAY10595 have?

CAY10595 has 1 hydrogen bond donor count.

Is the compound of CAY10595 canonicalized?

Yes, the compound of CAY10595 is canonicalized.