![neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate structure](/static/products/4000/400074-50-2.webp)
neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate
TL;DR: neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate (CAS 400074-50-2) is a chemical compound with molecular formula C14H16ClN3O2S2 and molecular weight 357.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethylpropyl N-[5-(4-chlorophenyl)sulfanylthiadiazol-4-yl]carbamate
Also Known As: 10M-544S, neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate, 2,2-dimethylpropyl N-[5-(4-chlorophenyl)sulfanylthiadiazol-4-yl]carbamate, 2,2-dimethylpropyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate
| Molecular Formula | C14H16ClN3O2S2 |
|---|---|
| Molecular Weight | 357.04 g/mol |
| LogP | 4.9373 |
| Topological Polar Surface Area | 64.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 357.03726 |
| Heavy Atoms | 22 |
| Complexity | 638.28265 |
Chemical Identifiers
| CAS Number | 400074-50-2 |
|---|---|
| SMILES | CC(C)(C)COC(=O)NC1=C(SN=N1)SC2=CC=C(C=C2)Cl |
Product Overview
neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate (CAS 400074-50-2), with molecular formula C14H16ClN3O2S2 and molecular weight 357.04 g/mol. IUPAC: 2,2-dimethylpropyl N-[5-(4-chlorophenyl)sulfanylthiadiazol-4-yl]carbamate.
Chemical Property Profile of neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate
Property Insights of neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate
The XLogP value of 4.9373 indicates that neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.11 Ų falls within the moderate polarity range, balancing permeability and solubility for neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate. Following Lipinski's Rule of Five, neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate has 1 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 neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate?
The CAS number of neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate is 400074-50-2.
What is the molecular formula of neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate?
The molecular formula of neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate is C14H16ClN3O2S2.
What is the molecular weight of neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate?
The molecular weight of neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate is 357.04 g/mol.
Where can I buy neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate?
You can request a quote for neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate?
Yes, KEHONG BIO provides custom synthesis services for neopentyl N-{5-[(4-chlorophenyl)sulfanyl]-1,2,3-thiadiazol-4-yl}carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.