| CAS Number | 1020157-01-0 |
| Catalog Number | AG0091WC(AGN-PC-0WBLX6) |
| Chemical Name | N-2 Trityl Olmesartan Medoxomil |
| IUPAC Name | (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl 5-(2-hydroxypropan-2-yl)-2-propyl-3-[[4-[2-(2-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylate |
| InChI | InChI=1S/C48H44N6O6/c1-5-17-41-49-43(47(3,4)57)42(45(55)58-31-40-32(2)59-46(56)60-40)53(41)30-33-26-28-34(29-27-33)38-24-15-16-25-39(38)44-50-52-54(51-44)48(35-18-9-6-10-19-35,36-20-11-7-12-21-36)37-22-13-8-14-23-37/h6-16,18-29,57H,5,17,30-31H2,1-4H3 |
| InChI Key | KKYFOXOGKNDKRS-UHFFFAOYSA-N |
| MDL Number | MFCD20272387 |
| Molecular Formula | C48H44N6O6 |
| Molecular Weight | 800.8996 |
| SMILES | CCCc1nc(c(C(=O)OCC2=C(C)OC(=O)O2)n1Cc3ccc(cc3)c4ccccc4c5nnn(n5)C(c6ccccc6)(c7ccccc7)c8ccccc8)C(C)(C)O |
| UNII | KIU4Z454AM |
| Synonyms | N2-Trityl olmesartan medoxomil,
UNII-KIU4Z454AM,
1020157-01-0,
KIU4Z454AM,
N2-Tritylolmesartan medoxomil,
Olmesartan medoxomil impurity D [EP],
SCHEMBL94332,
(5-Methyl-2-oxo-1,3-dioxol-4-yl)methyl 4-(1-hydroxy-1-methylethyl)-2-propyl-1-((2'-((2-triphenylmethyl)-2H-tetrazol-5-yl)biphenyl-4-yl)methyl)-1H-imidazole-5-carboxylate,
1H-Imidazole-5-carboxylic acid, 4-(1-hydroxy-1-methylethyl)-2-propyl-1-((2'-(2-(triphenylmethyl)-2H-tetrazol-5-yl)(1,1'-biphenyl)-4-yl)methyl)-, (5-methyl-2-oxo-1,3-dioxol-4-yl)methyl ester,
4-(1-Hydroxy-1-methylethyl)-2-propyl-1-[2'-(2-trityl-2H-tetrazole-5-yl)-4-biphenylylmethyl]-1H-imidazole-5-carboxylic acid (5-methyl-2-oxo-1,3-dioxole-4-yl)methyl ester,
Trityl Olmesartan Medoxomil,
Olmesartan Medoxomil EP Impurity D,
CS-T-62583,
CID10700531,
CID 10700531,
|
| Complexity | 1420 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 800.332g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 60 |
| Hydrogen Bond Acceptor Count | 10 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 800.916g/mol |
| Monoisotopic Mass | 800.332g/mol |
| Rotatable Bond Count | 15 |
| Topological Polar Surface Area | 144A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 9.2 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number