3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea
TL;DR: 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea (CAS 115952-25-5) is a chemical compound with molecular formula C10H10ClN3O2S and molecular weight 271.01822 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(5-chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea
Also Known As: 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea, Urea,N'-(5-chloro-1,2-benzisothiazol-3-yl)-N-methoxy-N-methyl-, N'-(5-Chloro-1,2-benzothiazol-3-yl)-N-methoxy-N-methylurea, tert-Butyl 4-chloro-8,9-dihydro-5H-pyrimido[4,5-d]azepine-7(6H)-carboxylate, 3-(3-chloro-7-thia-8-azabicyclo[4.3.0]nona-2,4,8,10-tetraen-9-yl)-1-methoxy-1-methyl-urea
Technical Specifications
| Molecular Formula | C10H10ClN3O2S |
| Molecular Weight | 271.01822 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 82.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 271.01822 Da |
| Heavy Atoms | 17 |
| Complexity | 295.0 |
| SMILES | CN(C(=O)NC1=NSC2=C1C=C(C=C2)Cl)OC |
| InChIKey | WVTKSRSKNLEJPC-UHFFFAOYSA-N |
Chemical Property Profile of 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea
Property Insights of 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea. The TPSA of 82.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea. Following Lipinski's Rule of Five, 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea 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
What is the CAS number of 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea?
The CAS number of 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea is 115952-25-5.
What is the molecular formula of 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea?
The molecular formula of 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea is C10H10ClN3O2S.
What is the molecular weight of 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea?
The molecular weight of 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea is 271.01822 g/mol.
Where can I buy 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea?
You can request a quote for 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea?
Yes, CoreyChem provides custom synthesis services for 3-(5-Chloro-1,2-benzothiazol-3-yl)-1-methoxy-1-methylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.