(1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide
TL;DR: (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide (CAS 303013-03-8) is a chemical compound with molecular formula C32H54B2N4 and molecular weight 516.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[phenyl-[3-[phenyl-(propan-2-ylamino)methylidene]-2,2,4,4-tetra(propan-2-yl)-1,3-diazonia-2,4-diboranuidacyclobut-1-ylidene]methyl]propan-2-amine
Also Known As: (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide, N-[phenyl-[3-[phenyl-(propan-2-ylamino)methylidene]-2,2,4,4-tetra(propan-2-yl)-1,3-diazonia-2,4-diboranuidacyclobut-1-ylidene]methyl]propan-2-amine
| Molecular Formula | C32H54B2N4 |
|---|---|
| Molecular Weight | 516.45 g/mol |
| LogP | 7.439 |
| Topological Polar Surface Area | 30.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 8 |
| Exact Mass | 516.4534 |
| Heavy Atoms | 38 |
| Complexity | 1009.0642 |
Chemical Identifiers
| CAS Number | 303013-03-8 |
|---|---|
| SMILES | [B-]\1(/[N+](=C(\NC(C)C)/C2=CC=CC=C2)/[B-](/[N+]1=C(/NC(C)C)\C3=CC=CC=C3)(C(C)C)C(C)C)(C(C)C)C(C)C |
Product Overview
(1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide (CAS 303013-03-8), with molecular formula C32H54B2N4 and molecular weight 516.45 g/mol. IUPAC: N-[phenyl-[3-[phenyl-(propan-2-ylamino)methylidene]-2,2,4,4-tetra(propan-2-yl)-1,3-diazonia-2,4-diboranuidacyclobut-1-ylidene]methyl]propan-2-amine.
Chemical Property Profile of (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide
Property Insights of (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide
The XLogP value of 7.439 indicates that (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.08 Ų, (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide has 2 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide?
The CAS number of (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide is 303013-03-8.
What is the molecular formula of (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide?
The molecular formula of (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide is C32H54B2N4.
What is the molecular weight of (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide?
The molecular weight of (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide is 516.45 g/mol.
Where can I buy (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide?
You can request a quote for (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide?
Yes, KEHONG BIO provides custom synthesis services for (1Z,3Z)-2,2,4,4-tetraisopropyl-1,3-bis((isopropylamino)(phenyl)methylene)-1,3,2,4-diazadiboretidine-1,3-diium-2,4-diuide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.