J3.159.741B
TL;DR: J3.159.741B (CAS 35984-93-1) is a chemical compound with molecular formula C48H48N8 and molecular weight 736.40 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6,15,24,33-tetratert-butyl-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3(40),4(9),5,7,10,12(39),13(18),14,16,19,21(38),22(27),23,25,28,30(37),31(36),32,34-icosaene
Also Known As: J3.159.741B, 6,15,24,33-Tetratert-butyl-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3(40),4(9),5,7,10,12(39),13(18),14,16,19,21(38),22(27),23,25,28,30(37),31(36),32,34-icosaene, 22,72,122,172-Tetra-tert-butyl-21,23-didehydro-5,10,15,20-tetraaza-21H,23H-tetrabenzo[b,g,l,q]porphyrin, 6,15,24,33-tetra-tert-butyl-2,11,20,29,37,38,39,40-octaazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3(40),4,6,8,10,12(39),13,15,17,19,21(38),22,24,26,28,30(37),31,33,35-icosaene
| Molecular Formula | C48H48N8 |
|---|---|
| Molecular Weight | 736.40 g/mol |
| LogP | 12.2 |
| Topological Polar Surface Area | 98.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 736.4002 |
| Heavy Atoms | 56 |
| Complexity | 1600.0 |
Chemical Identifiers
| CAS Number | 35984-93-1 |
|---|---|
| SMILES | CC(C)(C)C1=CC2=C(C=C1)C3=NC4=NC(=NC5=NC(=NC6=NC(=NC2=N3)C7=C6C=C(C=C7)C(C)(C)C)C8=C5C=C(C=C8)C(C)(C)C)C9=C4C=C(C=C9)C(C)(C)C |
| InChIKey | LPIMSYGSPXXZEU-UHFFFAOYSA-N |
Product Overview
J3.159.741B (CAS 35984-93-1), with molecular formula C48H48N8 and molecular weight 736.40 g/mol. IUPAC: 6,15,24,33-tetratert-butyl-2,11,20,29,37,38,39,40-octazanonacyclo[28.6.1.13,10.112,19.121,28.04,9.013,18.022,27.031,36]tetraconta-1,3(40),4(9),5,7,10,12(39),13(18),14,16,19,21(38),22(27),23,25,28,30(37),31(36),32,34-icosaene.
Chemical Property Profile of J3.159.741B
Property Insights of J3.159.741B
The XLogP value of 12.2 indicates that J3.159.741B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.9 Ų falls within the moderate polarity range, balancing permeability and solubility for J3.159.741B. Following Lipinski's Rule of Five, J3.159.741B has 0 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 J3.159.741B?
The CAS number of J3.159.741B is 35984-93-1.
What is the molecular formula of J3.159.741B?
The molecular formula of J3.159.741B is C48H48N8.
What is the molecular weight of J3.159.741B?
The molecular weight of J3.159.741B is 736.40 g/mol.
Where can I buy J3.159.741B?
You can request a quote for J3.159.741B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J3.159.741B?
Yes, KEHONG BIO provides custom synthesis services for J3.159.741B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.