Biib 513
TL;DR: Biib 513 (CAS 265986-98-9) is a chemical compound with molecular formula C19H25N5O8S2 and molecular weight 515.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(diaminomethylidene)-4-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methylsulfonylbenzamide;methanesulfonic acid
Also Known As: Biib 513, SID:135653745, Benzamide, N-(aminoiminomethyl)-4-(4-(2-furanylcarbonyl)-1-piperazinyl)-3-(methylsulfonyl)-, methanesulfonate (1:1), Benzamide, N-(aminoiminomethyl)-4-(4-(2-furanylcarbonyl)-1-piperazinyl)-3-(methylsulfonyl)-, monomethanesulfonate, Benzamide, N-(diaminomethylene)-4-(4-(2-furanylcarbonyl)-1-piperazinyl)-3-(methylsulfonyl)-
| Molecular Formula | C19H25N5O8S2 |
|---|---|
| Molecular Weight | 515.11 g/mol |
| LogP | -0.4369 |
| Topological Polar Surface Area | 206.67 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 515.11444 |
| Heavy Atoms | 34 |
| Complexity | 1267.949 |
Chemical Identifiers
| CAS Number | 265986-98-9 |
|---|---|
| SMILES | CS(=O)(=O)C1=C(C=CC(=C1)C(=O)N=C(N)N)N2CCN(CC2)C(=O)C3=CC=CO3.CS(=O)(=O)O |
Product Overview
Biib 513 (CAS 265986-98-9), with molecular formula C19H25N5O8S2 and molecular weight 515.11 g/mol. IUPAC: N-(diaminomethylidene)-4-[4-(furan-2-carbonyl)piperazin-1-yl]-3-methylsulfonylbenzamide;methanesulfonic acid.
Chemical Property Profile of Biib 513
Property Insights of Biib 513
The XLogP value of -0.4369 indicates that Biib 513 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 206.67 Ų indicates high polarity, suggesting Biib 513 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Biib 513 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Biib 513?
The CAS number of Biib 513 is 265986-98-9.
What is the molecular formula of Biib 513?
The molecular formula of Biib 513 is C19H25N5O8S2.
What is the molecular weight of Biib 513?
The molecular weight of Biib 513 is 515.11 g/mol.
Where can I buy Biib 513?
You can request a quote for Biib 513 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Biib 513?
Yes, KEHONG BIO provides custom synthesis services for Biib 513 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.