2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole
TL;DR: 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole (CAS 785792-29-2) is a chemical compound with molecular formula C14H18ClN3O3S and molecular weight 343.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(chloromethyl)-1-ethylbenzimidazol-5-yl]sulfonylmorpholine
Also Known As: 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole, 2-(chloromethyl)-1-ethyl-5-(morpholin-4-ylsulfonyl)-1H-benzimidazole, 4-[2-(chloromethyl)-1-ethylbenzimidazol-5-yl]sulfonylmorpholine, 4-[2-(chloromethyl)-1-ethyl-benzimidazol-5-yl]sulfonylmorpholine, 2-(Chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-benzimidazole
| Molecular Formula | C14H18ClN3O3S |
|---|---|
| Molecular Weight | 343.08 g/mol |
| LogP | 1.8159 |
| Topological Polar Surface Area | 64.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 343.07574 |
| Heavy Atoms | 22 |
| Complexity | 781.9721 |
Chemical Identifiers
| CAS Number | 785792-29-2 |
|---|---|
| SMILES | CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CCl |
Product Overview
2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole (CAS 785792-29-2), with molecular formula C14H18ClN3O3S and molecular weight 343.08 g/mol. IUPAC: 4-[2-(chloromethyl)-1-ethylbenzimidazol-5-yl]sulfonylmorpholine.
Chemical Property Profile of 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole
Property Insights of 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole
The XLogP value of 1.8159 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole. The TPSA of 64.43 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole. Following Lipinski's Rule of Five, 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole has 0 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 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole?
The CAS number of 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole is 785792-29-2.
What is the molecular formula of 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole?
The molecular formula of 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole is C14H18ClN3O3S.
What is the molecular weight of 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole?
The molecular weight of 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole is 343.08 g/mol.
Where can I buy 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole?
You can request a quote for 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-(chloromethyl)-1-ethyl-5-(morpholine-4-sulfonyl)-1H-1,3-benzodiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.