BB 24
TL;DR: BB 24 (CAS 77967-03-4) is a chemical compound with molecular formula C24H34IN3O3 and molecular weight 539.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-benzyl-2,4,6-trioxo-5,5-bis(prop-2-enyl)-1,3-diazinan-1-yl]ethyl-diethyl-methylazanium iodide
Also Known As: BB 24, Barbituric acid, 5,5-diallyl-1-benzyl-3-(2-(diethylmethylammonio)ethyl)-, iodide, Ammonium, (2-(1-benzyl-5,5-diallyl-2,4,6(1H,3H,5H)-trioxo-3-pyrimidinyl)ethyl)diethylmethyl-, iodide, 1(2H)-Pyrimidineethanaminium, N,N-diethyltetrahydro-N-methyl-2,4,6-trioxo-3-(phenylmethyl)-5,5-di-2-propenyl-, iodide, 2-[3-benzyl-2,4,6-trioxo-5,5-bis(prop-2-enyl)-1,3-diazinan-1-yl]ethyl-diethyl-methylazanium iodide
| Molecular Formula | C24H34IN3O3 |
|---|---|
| Molecular Weight | 539.16 g/mol |
| LogP | 0.61 |
| Topological Polar Surface Area | 57.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 539.1645 |
| Heavy Atoms | 31 |
| Complexity | 653.0 |
Chemical Identifiers
| CAS Number | 77967-03-4 |
|---|---|
| SMILES | CC[N+](C)(CC)CCN1C(=O)C(C(=O)N(C1=O)CC2=CC=CC=C2)(CC=C)CC=C.[I-] |
| InChIKey | NVUNKYBCKNGOPY-UHFFFAOYSA-M |
Product Overview
BB 24 (CAS 77967-03-4), with molecular formula C24H34IN3O3 and molecular weight 539.16 g/mol. IUPAC: 2-[3-benzyl-2,4,6-trioxo-5,5-bis(prop-2-enyl)-1,3-diazinan-1-yl]ethyl-diethyl-methylazanium iodide.
Chemical Property Profile of BB 24
Property Insights of BB 24
The XLogP value of 0.61 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BB 24. With a topological polar surface area (TPSA) of 57.7 Ų, BB 24 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, BB 24 has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BB 24?
The CAS number of BB 24 is 77967-03-4.
What is the molecular formula of BB 24?
The molecular formula of BB 24 is C24H34IN3O3.
What is the molecular weight of BB 24?
The molecular weight of BB 24 is 539.16 g/mol.
Where can I buy BB 24?
You can request a quote for BB 24 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BB 24?
Yes, KEHONG BIO provides custom synthesis services for BB 24 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.