Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester
TL;DR: Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester (CAS 112390-00-8) is a chemical compound with molecular formula C6H13N3S and molecular weight 159.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N'-(butan-2-ylideneamino)carbamimidothioate
Also Known As: methyl N'-(butan-2-ylideneamino)carbamimidothioate, Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester, Methyl N'-(butan-2-ylidene)carbamohydrazonothioate, N'-(butan-2-ylideneamino)-1-methylsulfanyl-methanimidamide, Hydrazinecarboximidothioic acid,(1-methylpropylidene)-,methyl ester
| Molecular Formula | C6H13N3S |
|---|---|
| Molecular Weight | 159.08 g/mol |
| LogP | 1.45 |
| Topological Polar Surface Area | 50.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 159.08302 |
| Heavy Atoms | 10 |
| Complexity | 133.07191 |
Chemical Identifiers
| CAS Number | 112390-00-8 |
|---|---|
| SMILES | CCC(=NN=C(N)SC)C |
Product Overview
Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester (CAS 112390-00-8), with molecular formula C6H13N3S and molecular weight 159.08 g/mol. IUPAC: methyl N'-(butan-2-ylideneamino)carbamimidothioate.
Chemical Property Profile of Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester
Property Insights of Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester
The XLogP value of 1.45 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester. With a topological polar surface area (TPSA) of 50.74 Ų, Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester 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 Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester?
The CAS number of Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester is 112390-00-8.
What is the molecular formula of Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester?
The molecular formula of Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester is C6H13N3S.
What is the molecular weight of Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester?
The molecular weight of Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester is 159.08 g/mol.
Where can I buy Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester?
You can request a quote for Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester?
Yes, KEHONG BIO provides custom synthesis services for Hydrazinecarboximidothioic acid, (1-methylpropylidene)-, methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.