(3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate
TL;DR: (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate (CAS 857038-78-9) is a chemical compound with molecular formula C18H17Cl2N3O5S and molecular weight 457.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(3,5-dichloro-4-methyl-2-pyridinyl)amino]-2-oxoethyl] 2-[[(E)-2-phenylethenyl]sulfonylamino]acetate
Also Known As: (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate, [(3,5-dichloro-4-methylpyridin-2-yl)carbamoyl]methyl 2-(2-phenylethenesulfonamido)acetate, [2-[(3,5-dichloro-4-methylpyridin-2-yl)amino]-2-oxoethyl] 2-[[(E)-2-phenylethenyl]sulfonylamino]acetate
| Molecular Formula | C18H17Cl2N3O5S |
|---|---|
| Molecular Weight | 457.03 g/mol |
| LogP | 2.76882 |
| Topological Polar Surface Area | 114.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 457.0266 |
| Heavy Atoms | 29 |
| Complexity | 1027.2921 |
Chemical Identifiers
| CAS Number | 857038-78-9 |
|---|---|
| SMILES | CC1=C(C(=NC=C1Cl)NC(=O)COC(=O)CNS(=O)(=O)/C=C/C2=CC=CC=C2)Cl |
Product Overview
(3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate (CAS 857038-78-9), with molecular formula C18H17Cl2N3O5S and molecular weight 457.03 g/mol. IUPAC: [2-[(3,5-dichloro-4-methyl-2-pyridinyl)amino]-2-oxoethyl] 2-[[(E)-2-phenylethenyl]sulfonylamino]acetate.
Chemical Property Profile of (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate
Property Insights of (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate
The XLogP value of 2.76882 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate. The TPSA of 114.46 Ų falls within the moderate polarity range, balancing permeability and solubility for (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate. Following Lipinski's Rule of Five, (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate has 2 hydrogen bond donor(s) and 6 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 (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate?
The CAS number of (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate is 857038-78-9.
What is the molecular formula of (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate?
The molecular formula of (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate is C18H17Cl2N3O5S.
What is the molecular weight of (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate?
The molecular weight of (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate is 457.03 g/mol.
Where can I buy (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate?
You can request a quote for (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate?
Yes, KEHONG BIO provides custom synthesis services for (3,5-dichloro-4-methyl-pyridin-2-yl)carbamoylmethyl 2-(2-phenylethenylsulfonylamino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.