![[5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate structure](/static/products/864/86422-07-3.png)
[5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate
TL;DR: [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate (CAS 86422-07-3) is a chemical compound with molecular formula C27H36Cl2N4O6 and molecular weight 582.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate
Also Known As: [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate|5-(3,4-Dichlorophenyl)-6,7-bis({[(propan-2-yl)carbamoyl]oxy}methyl)-2,3-dihydro-1H-pyrrolizin-2-yl N,N-dimethylglycinate|Glycine,N-dimethyl-, 5-(3,4-dichlorophenyl)-2,3-dihydro-6,7-bis[[[[(1-methylethyl)amino]carbonyl]oxy]methyl]-1H-pyrrolizin-2-yl ester, (R)-
| Molecular Formula | C27H36Cl2N4O6 |
|---|---|
| Molecular Weight | 582.20 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 111.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 13 |
| Exact Mass | 582.2012 |
| Heavy Atoms | 39 |
| Complexity | 847.0 |
Chemical Identifiers
| CAS Number | 86422-07-3 |
|---|---|
| SMILES | CC(C)NC(=O)OCC1=C2CC(CN2C(=C1COC(=O)NC(C)C)C3=CC(=C(C=C3)Cl)Cl)OC(=O)CN(C)C |
| InChIKey | ZAQUAOCBNXNKTP-UHFFFAOYSA-N |
Product Overview
[5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate (CAS 86422-07-3), with molecular formula C27H36Cl2N4O6 and molecular weight 582.20 g/mol. IUPAC: [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate.
Chemical Property Profile of [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate
Property Insights of [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate
The XLogP value of 4.2 indicates that [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate. Following Lipinski's Rule of Five, [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate?
The CAS number of [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate is 86422-07-3.
What is the molecular formula of [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate?
The molecular formula of [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate is C27H36Cl2N4O6.
What is the molecular weight of [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate?
The molecular weight of [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate is 582.20 g/mol.
Where can I buy [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate?
You can request a quote for [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate?
Yes, KEHONG BIO provides custom synthesis services for [5-(3,4-dichlorophenyl)-6,7-bis(propan-2-ylcarbamoyloxymethyl)-2,3-dihydro-1H-pyrrolizin-2-yl] 2-(dimethylamino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.