AB00875260-06
TL;DR: AB00875260-06 (CAS 681269-95-4) is a chemical compound with molecular formula C22H27N3O4S and molecular weight 429.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyl-N-[4-[(6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)sulfonyl]phenyl]propanamide
Also Known As: AB00875260-06, F0542-0006, 2,2-dimethyl-N-[4-({6-oxo-7,11-diazatricyclo[7.3.1.0^{2,7}]trideca-2,4-dien-11-yl}sulfonyl)phenyl]propanamide, N-(4-((8-oxo-5,6-dihydro-1H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(2H,4H,8H)-yl)sulfonyl)phenyl)pivalamide, 2,2-dimethyl-N-[4-[(6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)sulfonyl]phenyl]propanamide
| Molecular Formula | C22H27N3O4S |
|---|---|
| Molecular Weight | 429.17 g/mol |
| LogP | 2.6409 |
| Topological Polar Surface Area | 88.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 429.17224 |
| Heavy Atoms | 30 |
| Complexity | 1130.208 |
Chemical Identifiers
| CAS Number | 681269-95-4 |
|---|---|
| SMILES | CC(C)(C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CC3CC(C2)C4=CC=CC(=O)N4C3 |
Product Overview
AB00875260-06 (CAS 681269-95-4), with molecular formula C22H27N3O4S and molecular weight 429.17 g/mol. IUPAC: 2,2-dimethyl-N-[4-[(6-oxo-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-11-yl)sulfonyl]phenyl]propanamide.
Chemical Property Profile of AB00875260-06
Property Insights of AB00875260-06
The XLogP value of 2.6409 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00875260-06. The TPSA of 88.48 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00875260-06. Following Lipinski's Rule of Five, AB00875260-06 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00875260-06?
The CAS number of AB00875260-06 is 681269-95-4.
What is the molecular formula of AB00875260-06?
The molecular formula of AB00875260-06 is C22H27N3O4S.
What is the molecular weight of AB00875260-06?
The molecular weight of AB00875260-06 is 429.17 g/mol.
Where can I buy AB00875260-06?
You can request a quote for AB00875260-06 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00875260-06?
Yes, KEHONG BIO provides custom synthesis services for AB00875260-06 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.