![ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate structure](/static/products/7123/712344-84-8.webp)
ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate
TL;DR: ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate (CAS 712344-84-8) is a chemical compound with molecular formula C12H13N5O3S and molecular weight 307.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate
Also Known As: CBKinase1_008437, CBKinase1_020837, ethyl {[(1-phenyl-1H-tetrazol-5-yl)thio]acetyl}carbamate, ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate, BRD-K23580264-001-01-8
| Molecular Formula | C12H13N5O3S |
|---|---|
| Molecular Weight | 307.07 g/mol |
| LogP | 1.0271 |
| Topological Polar Surface Area | 99.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 307.0739 |
| Heavy Atoms | 21 |
| Complexity | 616.3653 |
Chemical Identifiers
| CAS Number | 712344-84-8 |
|---|---|
| SMILES | CCOC(=O)NC(=O)CSC1=NN=NN1C2=CC=CC=C2 |
Product Overview
ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate (CAS 712344-84-8), with molecular formula C12H13N5O3S and molecular weight 307.07 g/mol. IUPAC: ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate.
Chemical Property Profile of ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate
Property Insights of ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate
The XLogP value of 1.0271 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate. The TPSA of 99.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate. Following Lipinski's Rule of Five, ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate has 1 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 ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate?
The CAS number of ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate is 712344-84-8.
What is the molecular formula of ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate?
The molecular formula of ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate is C12H13N5O3S.
What is the molecular weight of ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate?
The molecular weight of ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate is 307.07 g/mol.
Where can I buy ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate?
You can request a quote for ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate?
Yes, KEHONG BIO provides custom synthesis services for ethyl N-[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.