![methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate structure](/static/products/714/714241-01-7.png)
methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate
TL;DR: methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate (CAS 714241-01-7) is a chemical compound with molecular formula C10H8ClN3O2S and molecular weight 269.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate
Also Known As: methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate, methyl (5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl)carbamate, methyl [(2Z)-5-(2-chlorophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]carbamate, N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamic acid methyl ester
| Molecular Formula | C10H8ClN3O2S |
|---|---|
| Molecular Weight | 269.00 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 92.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.00256 |
| Heavy Atoms | 17 |
| Complexity | 282.0 |
Chemical Identifiers
| CAS Number | 714241-01-7 |
|---|---|
| SMILES | COC(=O)NC1=NN=C(S1)C2=CC=CC=C2Cl |
| InChIKey | CLPZQGXGPKJOMN-UHFFFAOYSA-N |
Product Overview
methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate (CAS 714241-01-7), with molecular formula C10H8ClN3O2S and molecular weight 269.00 g/mol. IUPAC: methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate.
Chemical Property Profile of methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate
Property Insights of methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate. Following Lipinski's Rule of Five, methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate has 1 hydrogen bond donor(s) and 5 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 methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate?
The CAS number of methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate is 714241-01-7.
What is the molecular formula of methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate?
The molecular formula of methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate is C10H8ClN3O2S.
What is the molecular weight of methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate?
The molecular weight of methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate is 269.00 g/mol.
Where can I buy methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate?
You can request a quote for methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-[5-(2-chlorophenyl)-1,3,4-thiadiazol-2-yl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.