AB00710558-01
TL;DR: AB00710558-01 (CAS 377772-92-4) is a chemical compound with molecular formula C27H38N2O5S and molecular weight 502.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[4-(diethylsulfamoyl)anilino]-2-oxoethyl] 3,5-ditert-butylbenzoate
Also Known As: AB00710558-01, 2-[[4-[(Diethylamino)sulfonyl]phenyl]amino]-2-oxoethyl 3,5-bis(1,1-dimethylethyl)benzoate, [2-[4-(diethylsulfamoyl)anilino]-2-oxoethyl] 3,5-ditert-butylbenzoate, 2-[4-(Diethylsulfamoyl)anilino]-2-oxoethyl 3,5-di-tert-butylbenzoate
| Molecular Formula | C27H38N2O5S |
|---|---|
| Molecular Weight | 502.25 g/mol |
| LogP | 5.1076 |
| Topological Polar Surface Area | 92.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 502.25015 |
| Heavy Atoms | 35 |
| Complexity | 1121.2883 |
Chemical Identifiers
| CAS Number | 377772-92-4 |
|---|---|
| SMILES | CCN(CC)S(=O)(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C |
Product Overview
AB00710558-01 (CAS 377772-92-4), with molecular formula C27H38N2O5S and molecular weight 502.25 g/mol. IUPAC: [2-[4-(diethylsulfamoyl)anilino]-2-oxoethyl] 3,5-ditert-butylbenzoate.
Chemical Property Profile of AB00710558-01
Property Insights of AB00710558-01
The XLogP value of 5.1076 indicates that AB00710558-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.78 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00710558-01. Following Lipinski's Rule of Five, AB00710558-01 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of AB00710558-01?
The CAS number of AB00710558-01 is 377772-92-4.
What is the molecular formula of AB00710558-01?
The molecular formula of AB00710558-01 is C27H38N2O5S.
What is the molecular weight of AB00710558-01?
The molecular weight of AB00710558-01 is 502.25 g/mol.
Where can I buy AB00710558-01?
You can request a quote for AB00710558-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00710558-01?
Yes, KEHONG BIO provides custom synthesis services for AB00710558-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.