2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate
TL;DR: 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate (CAS 442872-87-9) is a chemical compound with molecular formula C14H15ClN2O7S and molecular weight 390.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloroethyl 6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazole-3-carboxylate
Also Known As: 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate, 2-chloroethyl 6-(morpholinosulfonyl)-2-oxobenzo[d]oxazole-3(2H)-carboxylate, 2-chloroethyl 6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazole-3-carboxylate, A2635/0112172, 2-chloroethyl 6-(morpholin-4-ylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate
| Molecular Formula | C14H15ClN2O7S |
|---|---|
| Molecular Weight | 390.03 g/mol |
| LogP | 0.8389 |
| Topological Polar Surface Area | 108.05 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 390.02884 |
| Heavy Atoms | 25 |
| Complexity | 943.73126 |
Chemical Identifiers
| CAS Number | 442872-87-9 |
|---|---|
| SMILES | C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)C(=O)OCCCl |
Product Overview
2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate (CAS 442872-87-9), with molecular formula C14H15ClN2O7S and molecular weight 390.03 g/mol. IUPAC: 2-chloroethyl 6-morpholin-4-ylsulfonyl-2-oxo-1,3-benzoxazole-3-carboxylate.
Chemical Property Profile of 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate
Property Insights of 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate
The XLogP value of 0.8389 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate. The TPSA of 108.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate. Following Lipinski's Rule of Five, 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate has 0 hydrogen bond donor(s) and 7 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 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate?
The CAS number of 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate is 442872-87-9.
What is the molecular formula of 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate?
The molecular formula of 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate is C14H15ClN2O7S.
What is the molecular weight of 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate?
The molecular weight of 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate is 390.03 g/mol.
Where can I buy 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate?
You can request a quote for 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-chloroethyl 6-(4-morpholinylsulfonyl)-2-oxo-1,3-benzoxazole-3(2H)-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.