Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo-
TL;DR: Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo- (CAS 25903-29-1) is a chemical compound with molecular formula C31H34I6N4O8 and molecular weight 1351.66 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(butanoylamino)methyl]-5-[[7-[3-[(butanoylamino)methyl]-5-carboxy-2,4,6-triiodoanilino]-7-oxoheptanoyl]amino]-2,4,6-triiodobenzoic acid
Also Known As: BENZOIC ACID, 3,3'-(PIMELOYLDIIMINO)BIS(5-(BUTYRAMIDOMETHYL)-2,4,6-TRIIODO-, 3,3'-Pimeloyldiiminobis(5-(butyramidomethyl)-2,4,6-triiodobenzoic acid), 3,3 -(Pimeloyldiimino)bis[5-(butyrylaminomethyl)-2,4,6-triiodobenzoic acid], 3,3'-[(1,7-Dioxoheptane-1,7-diyl)bis(azanediyl)]bis[5-(butanamidomethyl)-2,4,6-triiodobenzoic acid], 3-(BUTANAMIDOMETHYL)-5-(6-{[3-(BUTANAMIDOMETHYL)-5-CARBOXY-2,4,6-TRIIODOPHENYL]CARBAMOYL}HEXANAMIDO)-2,4,6-TRIIODOBENZOIC ACID
| Molecular Formula | C31H34I6N4O8 |
|---|---|
| Molecular Weight | 1351.66 g/mol |
| LogP | 5.9 |
| Topological Polar Surface Area | 191.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 18 |
| Exact Mass | 1351.6646 |
| Heavy Atoms | 49 |
| Complexity | 1090.0 |
Chemical Identifiers
| CAS Number | 25903-29-1 |
|---|---|
| SMILES | CCCC(=O)NCC1=C(C(=C(C(=C1I)NC(=O)CCCCCC(=O)NC2=C(C(=C(C(=C2I)C(=O)O)I)CNC(=O)CCC)I)I)C(=O)O)I |
| InChIKey | CSEUCNSOUPZKGZ-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo- (CAS 25903-29-1), with molecular formula C31H34I6N4O8 and molecular weight 1351.66 g/mol. IUPAC: 3-[(butanoylamino)methyl]-5-[[7-[3-[(butanoylamino)methyl]-5-carboxy-2,4,6-triiodoanilino]-7-oxoheptanoyl]amino]-2,4,6-triiodobenzoic acid.
Chemical Property Profile of Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo-
Property Insights of Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo-
The XLogP value of 5.9 indicates that Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 191.0 Ų indicates high polarity, suggesting Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo- has 6 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo-?
The CAS number of Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo- is 25903-29-1.
What is the molecular formula of Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo-?
The molecular formula of Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo- is C31H34I6N4O8.
What is the molecular weight of Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo-?
The molecular weight of Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo- is 1351.66 g/mol.
Where can I buy Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo-?
You can request a quote for Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 3,3'-(pimeloyldiimino)bis(5-(butyramidomethyl)-2,4,6-triiodo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.