ChemDiv3_005105
TL;DR: ChemDiv3_005105 (CAS 461447-98-3) is a chemical compound with molecular formula C24H29N3O5 and molecular weight 439.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[2-(3-methoxyanilino)-2-oxoethoxy]phenyl]-N-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide
Also Known As: ChemDiv3_005105, IDI1_023015, BRD-A50201771-001-01-5, 1-[4-[2-(3-methoxyanilino)-2-oxoethoxy]phenyl]-N-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide, N-isobutyl-1-(4-{2-[(3-methoxyphenyl)amino]-2-oxoethoxy}phenyl)-5-oxo-3-pyrrolidinecarboxamide
| Molecular Formula | C24H29N3O5 |
|---|---|
| Molecular Weight | 439.21 g/mol |
| LogP | 2.8378 |
| Topological Polar Surface Area | 96.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 439.21072 |
| Heavy Atoms | 32 |
| Complexity | 958.362 |
Chemical Identifiers
| CAS Number | 461447-98-3 |
|---|---|
| SMILES | CC(C)CNC(=O)C1CC(=O)N(C1)C2=CC=C(C=C2)OCC(=O)NC3=CC(=CC=C3)OC |
Product Overview
ChemDiv3_005105 (CAS 461447-98-3), with molecular formula C24H29N3O5 and molecular weight 439.21 g/mol. IUPAC: 1-[4-[2-(3-methoxyanilino)-2-oxoethoxy]phenyl]-N-(2-methylpropyl)-5-oxopyrrolidine-3-carboxamide.
Chemical Property Profile of ChemDiv3_005105
Property Insights of ChemDiv3_005105
The XLogP value of 2.8378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_005105. The TPSA of 96.97 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv3_005105. Following Lipinski's Rule of Five, ChemDiv3_005105 has 2 hydrogen bond donor(s) and 5 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 ChemDiv3_005105?
The CAS number of ChemDiv3_005105 is 461447-98-3.
What is the molecular formula of ChemDiv3_005105?
The molecular formula of ChemDiv3_005105 is C24H29N3O5.
What is the molecular weight of ChemDiv3_005105?
The molecular weight of ChemDiv3_005105 is 439.21 g/mol.
Where can I buy ChemDiv3_005105?
You can request a quote for ChemDiv3_005105 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_005105?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_005105 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.