[1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea
TL;DR: [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea (CAS 45096-47-7) is a chemical compound with molecular formula C5H11N7S and molecular weight 201.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea
Also Known As: NCIOpen2_006145, Pyruvaldehyd-1-guanylhydrazone-2-thiosemicarbazone, [1-(diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea
| Molecular Formula | C5H11N7S |
|---|---|
| Molecular Weight | 201.08 g/mol |
| LogP | -1.5453 |
| Topological Polar Surface Area | 127.17 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 201.07967 |
| Heavy Atoms | 13 |
| Complexity | 262.05646 |
Chemical Identifiers
| CAS Number | 45096-47-7 |
|---|---|
| SMILES | CC(=NNC(=S)N)C=NN=C(N)N |
Product Overview
[1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea (CAS 45096-47-7), with molecular formula C5H11N7S and molecular weight 201.08 g/mol. IUPAC: [1-(diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea.
Chemical Property Profile of [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea
Property Insights of [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea
The XLogP value of -1.5453 indicates that [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 127.17 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea. Following Lipinski's Rule of Five, [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea has 4 hydrogen bond donor(s) and 4 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 [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea?
The CAS number of [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea is 45096-47-7.
What is the molecular formula of [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea?
The molecular formula of [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea is C5H11N7S.
What is the molecular weight of [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea?
The molecular weight of [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea is 201.08 g/mol.
Where can I buy [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea?
You can request a quote for [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea?
Yes, KEHONG BIO provides custom synthesis services for [1-(Diaminomethylidenehydrazinylidene)propan-2-ylideneamino]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.