Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate)
TL;DR: Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate) (CAS 915-74-2) is a chemical compound with molecular formula C29H30N2O4 and molecular weight 470.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl 5-[(3,4-dimethyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-3,4-dimethyl-1H-pyrrole-2-carboxylate
Also Known As: BAS 00379484, BENZYL 5,5'-METHYLENEBIS(3,4-DIMETHYL-1H-PYRROLE-2-CARBOXYLATE), 5,5'-Di(benzyloxycarbonyl)-3,3',4,4'-tetramethyl-2,2'-dipyrrylmethane, dibenzyl 5,5'-methanediylbis(3,4-dimethyl-1h-pyrrole-2-carboxylate), benzyl 5-[(3,4-dimethyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-3,4-dimethyl-1H-pyrrole-2-carboxylate
| Molecular Formula | C29H30N2O4 |
|---|---|
| Molecular Weight | 470.22 g/mol |
| LogP | 6.3 |
| Topological Polar Surface Area | 84.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 470.22055 |
| Heavy Atoms | 35 |
| Complexity | 645.0 |
Chemical Identifiers
| CAS Number | 915-74-2 |
|---|---|
| SMILES | CC1=C(NC(=C1C)C(=O)OCC2=CC=CC=C2)CC3=C(C(=C(N3)C(=O)OCC4=CC=CC=C4)C)C |
| InChIKey | CYNZLUUUTZXXHF-UHFFFAOYSA-N |
Product Overview
Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate) (CAS 915-74-2), with molecular formula C29H30N2O4 and molecular weight 470.22 g/mol. IUPAC: benzyl 5-[(3,4-dimethyl-5-phenylmethoxycarbonyl-1H-pyrrol-2-yl)methyl]-3,4-dimethyl-1H-pyrrole-2-carboxylate.
Chemical Property Profile of Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate)
Property Insights of Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate)
The XLogP value of 6.3 indicates that Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate). Following Lipinski's Rule of Five, Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate) has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate)?
The CAS number of Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate) is 915-74-2.
What is the molecular formula of Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate)?
The molecular formula of Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate) is C29H30N2O4.
What is the molecular weight of Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate)?
The molecular weight of Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate) is 470.22 g/mol.
Where can I buy Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate)?
You can request a quote for Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate)?
Yes, KEHONG BIO provides custom synthesis services for Benzyl 5,5'-methylenebis(3,4-dimethyl-1H-pyrrole-2-carboxylate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.