![tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate structure](/static/products/4978/497848-75-6.webp)
tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate
TL;DR: tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate (CAS 497848-75-6) is a chemical compound with molecular formula C17H23IN2O3 and molecular weight 430.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 2-[(4-iodo-2-methylphenyl)carbamoyl]pyrrolidine-1-carboxylate
Also Known As: BAS 00524696, tert-butyl 2-[(4-iodo-2-methylphenyl)carbamoyl]pyrrolidine-1-carboxylate, tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate, tert-butyl 2-((4-iodo-2-methylphenyl)carbamoyl)pyrrolidine-1-carboxylate, tert-Butyl 2-[(4-iodo-2-methylanilino)carbonyl]-1-pyrrolidinecarboxylate
| Molecular Formula | C17H23IN2O3 |
|---|---|
| Molecular Weight | 430.08 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 58.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 430.07535 |
| Heavy Atoms | 23 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 497848-75-6 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)I)NC(=O)C2CCCN2C(=O)OC(C)(C)C |
| InChIKey | VAANKQNGDLYEQG-UHFFFAOYSA-N |
Product Overview
tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate (CAS 497848-75-6), with molecular formula C17H23IN2O3 and molecular weight 430.08 g/mol. IUPAC: tert-butyl 2-[(4-iodo-2-methylphenyl)carbamoyl]pyrrolidine-1-carboxylate.
Chemical Property Profile of tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate
Property Insights of tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate
The XLogP value of 3.6 indicates that tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.6 Ų, tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate?
The CAS number of tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate is 497848-75-6.
What is the molecular formula of tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate?
The molecular formula of tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate is C17H23IN2O3.
What is the molecular weight of tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate?
The molecular weight of tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate is 430.08 g/mol.
Where can I buy tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate?
You can request a quote for tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for tert-butyl 2-[N-(4-iodo-2-methylphenyl)carbamoyl]pyrrolidinecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.