Name: Name:Acetamide, N-[3',6'-bis(dimethylamino)-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-5(or 6)-yl]-2-iodo- (9CI)
Brand: Angene
SKU: AG00121P
Rating: 90 (10 reviews)

Acetamide, N-[3',6'-bis(dimethylamino)-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-5(or 6)-yl]-2-iodo- (9CI)

CAS No.:

136538-85-7

Catalog Number:

AG00121P

Molecular Formula:

C26H24IN3O4

Molecular Weight:

569.3909

Catalog Number:

AG00121P

Chemical Name:

Acetamide, N-[3',6'-bis(dimethylamino)-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-5(or 6)-yl]-2-iodo- (9CI)

CAS Number:

136538-85-7

Molecular Formula:

C26H24IN3O4

Molecular Weight:

569.3909

MDL Number:

MFCD27976609

IUPAC Name:

N-[3',6'-bis(dimethylamino)-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl]-2-iodoacetamide

InChI:

InChI=1S/C26H24IN3O4/c1-29(2)16-6-9-20-22(12-16)33-23-13-17(30(3)4)7-10-21(23)26(20)19-8-5-15(28-24(31)14-27)11-18(19)25(32)34-26/h5-13H,14H2,1-4H3,(H,28,31)

InChI Key:

HENCSKZMSUJDLA-UHFFFAOYSA-N

SMILES:

ICC(=O)Nc1ccc2c(c1)C(=O)OC12c2ccc(cc2Oc2c1ccc(c2)N(C)C)N(C)C

Complexity:

760

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

569.081g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

569.399g/mol

Monoisotopic Mass:

569.081g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.2