Einecs 298-856-5
TL;DR: Einecs 298-856-5 (CAS 93839-83-9) is a chemical compound with molecular formula C16H24N4O2 and molecular weight 304.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-diamino-2-methoxy-N-(1-pyrrolidin-2-ylbut-3-enyl)benzamide
Also Known As: EINECS 298-856-5, N-((1-Allyl-2-pyrrolidinylmethyl))-4,5-diamino-2-methoxybenzamide, 4,5-diamino-2-methoxy-N-(1-pyrrolidin-2-ylbut-3-enyl)benzamide, N-[(1-ALLYL-2-PYRROLIDINYLMETHYL)]-4,5-DIAMINO-2-METHOXYBENZAMIDE, 4,5-Diamino-2-methoxy-N-[1-(pyrrolidin-2-yl)but-3-en-1-yl]benzene-1-carboximidic acid
| Molecular Formula | C16H24N4O2 |
|---|---|
| Molecular Weight | 304.19 g/mol |
| LogP | 1.2861 |
| Topological Polar Surface Area | 102.4 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 304.1899 |
| Heavy Atoms | 22 |
| Complexity | 553.32196 |
Chemical Identifiers
| CAS Number | 93839-83-9 |
|---|---|
| SMILES | COC1=CC(=C(C=C1C(=O)NC(CC=C)C2CCCN2)N)N |
Product Overview
Einecs 298-856-5 (CAS 93839-83-9), with molecular formula C16H24N4O2 and molecular weight 304.19 g/mol. IUPAC: 4,5-diamino-2-methoxy-N-(1-pyrrolidin-2-ylbut-3-enyl)benzamide.
Chemical Property Profile of Einecs 298-856-5
Property Insights of Einecs 298-856-5
The XLogP value of 1.2861 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Einecs 298-856-5. The TPSA of 102.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Einecs 298-856-5. Following Lipinski's Rule of Five, Einecs 298-856-5 has 4 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 Einecs 298-856-5?
The CAS number of Einecs 298-856-5 is 93839-83-9.
What is the molecular formula of Einecs 298-856-5?
The molecular formula of Einecs 298-856-5 is C16H24N4O2.
What is the molecular weight of Einecs 298-856-5?
The molecular weight of Einecs 298-856-5 is 304.19 g/mol.
Where can I buy Einecs 298-856-5?
You can request a quote for Einecs 298-856-5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 298-856-5?
Yes, KEHONG BIO provides custom synthesis services for Einecs 298-856-5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.