| CAS Number | 1462267-07-7 |
| Catalog Number | AG01E26N(AGN-PC-0WOM7P) |
| Chemical Name | 2-[2-[(4-Iodophenyl)amino]-2-oxoethoxy]-N-[2-(methylphenylamino)-2-oxoethyl]-benzamide |
| IUPAC Name | 2-[2-(4-iodoanilino)-2-oxoethoxy]-N-[2-(N-methylanilino)-2-oxoethyl]benzamide |
| InChI | InChI=1S/C24H22IN3O4/c1-28(19-7-3-2-4-8-19)23(30)15-26-24(31)20-9-5-6-10-21(20)32-16-22(29)27-18-13-11-17(25)12-14-18/h2-14H,15-16H2,1H3,(H,26,31)(H,27,29) |
| InChI Key | HFVDMJQQAKLUSN-UHFFFAOYSA-N |
| MDL Number | MFCD32631940 |
| Molecular Formula | C24H22IN3O4 |
| Molecular Weight | 543.3536 |
| SMILES | IC1=CC=C(C=C1)NC(COC1=C(C(=O)NCC(=O)N(C2=CC=CC=C2)C)C=CC=C1)=O |
| Synonyms | KUC107647N,
NCGC00241607,
NCGC607,
MLS003874050,
KUC107647N-02,
SMR002530685,
2-(2-((4-iodophenyl)amino)-2-oxoethoxy)-N-(2-(methyl(phenyl)amino)-2-oxoethyl)benzamide,
ksc-22-92-D69,
SCHEMBL16534468,
KUC107647N,
NCGC00241607-01,
KSC-242-13-2,
2-[2-[(4-Iodophenyl)amino]-2-oxoethoxy]-N-[2-(methylphenylamino)-2-oxoethyl]-benzamide,
1462267-07-7,
|
| Complexity | 633 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 543.066g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 32 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 543.361g/mol |
| Monoisotopic Mass | 543.066g/mol |
| Rotatable Bond Count | 8 |
| Topological Polar Surface Area | 87.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number