F0542-0016
TL;DR: F0542-0016 (CAS 681270-04-2) is a chemical compound with molecular formula C28H33N3O4S and molecular weight 507.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-[(6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)sulfonyl]phenyl]adamantane-1-carboxamide
Also Known As: F0542-0016, (3r,5r,7r)-N-(4-((8-oxo-5,6-dihydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(2H,4H,8H)-yl)sulfonyl)phenyl)adamantane-1-carboxamide, N-[4-({6-oxo-7,11-diazatricyclo[7.3.1.0^{2,7}]trideca-2,4-dien-11-yl}sulfonyl)phenyl]adamantane-1-carboxamide, N-[4-[(6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)sulfonyl]phenyl]adamantane-1-carboxamide, p-(1-adamantanylcarbonylamino)phenyl(oxo)-6-oxo-7,11-diazatricyclo[7.3.1.0(2),]trideca-2,4-dien-11-yl-lambda-sulfaniumolate
| Molecular Formula | C28H33N3O4S |
|---|---|
| Molecular Weight | 507.22 g/mol |
| LogP | 3.8112 |
| Topological Polar Surface Area | 88.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 507.21918 |
| Heavy Atoms | 36 |
| Complexity | 1344.9658 |
Chemical Identifiers
| CAS Number | 681270-04-2 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)C(=O)NC4=CC=C(C=C4)S(=O)(=O)N5CC6CC(C5)C7=CC=CC(=O)N7C6 |
Product Overview
F0542-0016 (CAS 681270-04-2), with molecular formula C28H33N3O4S and molecular weight 507.22 g/mol. IUPAC: N-[4-[(6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)sulfonyl]phenyl]adamantane-1-carboxamide.
Chemical Property Profile of F0542-0016
Property Insights of F0542-0016
The XLogP value of 3.8112 indicates that F0542-0016 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.48 Ų falls within the moderate polarity range, balancing permeability and solubility for F0542-0016. Following Lipinski's Rule of Five, F0542-0016 has 1 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 F0542-0016?
The CAS number of F0542-0016 is 681270-04-2.
What is the molecular formula of F0542-0016?
The molecular formula of F0542-0016 is C28H33N3O4S.
What is the molecular weight of F0542-0016?
The molecular weight of F0542-0016 is 507.22 g/mol.
Where can I buy F0542-0016?
You can request a quote for F0542-0016 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0542-0016?
Yes, KEHONG BIO provides custom synthesis services for F0542-0016 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.