J1.371.039B
TL;DR: J1.371.039B (CAS 129230-01-9) is a chemical compound with molecular formula C30H41N3O10 and molecular weight 603.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1,4-bis(3,4,5-trimethoxybenzoyl)piperazin-2-yl]methyl N-tert-butylcarbamate
Also Known As: J1.371.039B, Carbamic acid, (1,1-dimethylethyl)-, (1,4-bis(3,4,5-trimethoxybenzoyl)-2-piperazinyl)methyl ester, N,N'-Di-(3',4',5'-trimethoxybenzoyl)-2-N''-tert-butylcarbamoyloxymethylpiperazine, [1,4-bis(3,4,5-trimethoxybenzoyl)piperazin-2-yl]methyl N-tert-butylcarbamate, [1,4-Bis(3,4,5-trimethoxybenzoyl)piperazin-2-yl]methyl hydrogen tert-butylcarbonimidate
| Molecular Formula | C30H41N3O10 |
|---|---|
| Molecular Weight | 603.28 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 603.2792 |
| Heavy Atoms | 43 |
| Complexity | 902.0 |
Chemical Identifiers
| CAS Number | 129230-01-9 |
|---|---|
| SMILES | CC(C)(C)NC(=O)OCC1CN(CCN1C(=O)C2=CC(=C(C(=C2)OC)OC)OC)C(=O)C3=CC(=C(C(=C3)OC)OC)OC |
| InChIKey | SOMBNBNRGKHTPF-UHFFFAOYSA-N |
Product Overview
J1.371.039B (CAS 129230-01-9), with molecular formula C30H41N3O10 and molecular weight 603.28 g/mol. IUPAC: [1,4-bis(3,4,5-trimethoxybenzoyl)piperazin-2-yl]methyl N-tert-butylcarbamate.
Chemical Property Profile of J1.371.039B
Property Insights of J1.371.039B
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for J1.371.039B. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for J1.371.039B. Following Lipinski's Rule of Five, J1.371.039B has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of J1.371.039B?
The CAS number of J1.371.039B is 129230-01-9.
What is the molecular formula of J1.371.039B?
The molecular formula of J1.371.039B is C30H41N3O10.
What is the molecular weight of J1.371.039B?
The molecular weight of J1.371.039B is 603.28 g/mol.
Where can I buy J1.371.039B?
You can request a quote for J1.371.039B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J1.371.039B?
Yes, KEHONG BIO provides custom synthesis services for J1.371.039B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.