Name: Name:4-(([4-(2-METHOXYPHENOXY)PHENYL]SULFONYL)AMINO)BENZOIC ACID
Brand: Angene
SKU: AG00EJ5N
Rating: 90 (10 reviews)

4-(([4-(2-METHOXYPHENOXY)PHENYL]SULFONYL)AMINO)BENZOIC ACID

CAS No.:

612044-43-6

Catalog Number:

AG00EJ5N

Molecular Formula:

C20H17NO6S

Molecular Weight:

399.4171

Catalog Number:

AG00EJ5N

Chemical Name:

4-(([4-(2-METHOXYPHENOXY)PHENYL]SULFONYL)AMINO)BENZOIC ACID

CAS Number:

612044-43-6

Molecular Formula:

C20H17NO6S

Molecular Weight:

399.4171

MDL Number:

MFCD06261085

IUPAC Name:

4-[[4-(2-methoxyphenoxy)phenyl]sulfonylamino]benzoic acid

InChI:

InChI=1S/C20H17NO6S/c1-26-18-4-2-3-5-19(18)27-16-10-12-17(13-11-16)28(24,25)21-15-8-6-14(7-9-15)20(22)23/h2-13,21H,1H3,(H,22,23)

InChI Key:

BIGHNVSRBRABMR-UHFFFAOYSA-N

SMILES:

COc1ccccc1Oc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)C(=O)O

Complexity:

603

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

399.078g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

399.417g/mol

Monoisotopic Mass:

399.078g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

110A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.3