N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline
TL;DR: N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline (CAS 593238-00-7) is a chemical compound with molecular formula C15H19N5O4 and molecular weight 333.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline
Also Known As: CBKinase1_004294, CBKinase1_016694, BRD-K41165209-001-01-4, N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline, N-{2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl}-2-nitro-5-(pyrrolidin-1-yl)aniline
| Molecular Formula | C15H19N5O4 |
|---|---|
| Molecular Weight | 333.14 g/mol |
| LogP | 2.37732 |
| Topological Polar Surface Area | 106.56 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 333.1437 |
| Heavy Atoms | 24 |
| Complexity | 711.64 |
Chemical Identifiers
| CAS Number | 593238-00-7 |
|---|---|
| SMILES | CC1=NON=C1OCCNC2=C(C=CC(=C2)N3CCCC3)[N+](=O)[O-] |
Product Overview
N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline (CAS 593238-00-7), with molecular formula C15H19N5O4 and molecular weight 333.14 g/mol. IUPAC: N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline.
Chemical Property Profile of N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline
Property Insights of N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline
The XLogP value of 2.37732 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline. The TPSA of 106.56 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline. Following Lipinski's Rule of Five, N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline has 1 hydrogen bond donor(s) and 8 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 N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline?
The CAS number of N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline is 593238-00-7.
What is the molecular formula of N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline?
The molecular formula of N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline is C15H19N5O4.
What is the molecular weight of N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline?
The molecular weight of N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline is 333.14 g/mol.
Where can I buy N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline?
You can request a quote for N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[2-[(4-methyl-1,2,5-oxadiazol-3-yl)oxy]ethyl]-2-nitro-5-pyrrolidin-1-ylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.