methyl N-(pentan-2-ylideneamino)carbamodithioate
TL;DR: methyl N-(pentan-2-ylideneamino)carbamodithioate (CAS 26152-29-4) is a chemical compound with molecular formula C7H14N2S2 and molecular weight 190.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(pentan-2-ylideneamino)carbamodithioate
Also Known As: methyl N-(pentan-2-ylideneamino)carbamodithioate, methyl N-[(E)-pentan-2-ylideneamino]carbamodithioate
| Molecular Formula | C7H14N2S2 |
|---|---|
| Molecular Weight | 190.06 g/mol |
| LogP | 2.3999 |
| Topological Polar Surface Area | 24.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 190.05984 |
| Heavy Atoms | 11 |
| Complexity | 154.51956 |
Chemical Identifiers
| CAS Number | 26152-29-4 |
|---|---|
| SMILES | CCCC(=NNC(=S)SC)C |
Product Overview
methyl N-(pentan-2-ylideneamino)carbamodithioate (CAS 26152-29-4), with molecular formula C7H14N2S2 and molecular weight 190.06 g/mol. IUPAC: methyl N-(pentan-2-ylideneamino)carbamodithioate.
Chemical Property Profile of methyl N-(pentan-2-ylideneamino)carbamodithioate
Property Insights of methyl N-(pentan-2-ylideneamino)carbamodithioate
The XLogP value of 2.3999 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-(pentan-2-ylideneamino)carbamodithioate. With a topological polar surface area (TPSA) of 24.39 Ų, methyl N-(pentan-2-ylideneamino)carbamodithioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl N-(pentan-2-ylideneamino)carbamodithioate has 1 hydrogen bond donor(s) and 3 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-(pentan-2-ylideneamino)carbamodithioate?
The CAS number of methyl N-(pentan-2-ylideneamino)carbamodithioate is 26152-29-4.
What is the molecular formula of methyl N-(pentan-2-ylideneamino)carbamodithioate?
The molecular formula of methyl N-(pentan-2-ylideneamino)carbamodithioate is C7H14N2S2.
What is the molecular weight of methyl N-(pentan-2-ylideneamino)carbamodithioate?
The molecular weight of methyl N-(pentan-2-ylideneamino)carbamodithioate is 190.06 g/mol.
Where can I buy methyl N-(pentan-2-ylideneamino)carbamodithioate?
You can request a quote for methyl N-(pentan-2-ylideneamino)carbamodithioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl N-(pentan-2-ylideneamino)carbamodithioate?
Yes, KEHONG BIO provides custom synthesis services for methyl N-(pentan-2-ylideneamino)carbamodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.