1-(4-Methyl-2-pentylidene)semicarbazide
TL;DR: 1-(4-Methyl-2-pentylidene)semicarbazide (CAS 14066-72-9) is a chemical compound with molecular formula C7H15N3O and molecular weight 157.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-methylpentan-2-ylideneamino)urea
Also Known As: 4-methyl-2-pentanone semicarbazone, isobutyl methyl ketone semicarbazone, (4-methylpentan-2-ylideneamino)urea, 1-(4-METHYL-2-PENTYLIDENE)SEMICARBAZIDE, 2-Pentanone, 4-methyl-, semicarbazone
| Molecular Formula | C7H15N3O |
|---|---|
| Molecular Weight | 157.12 g/mol |
| LogP | 1.0767 |
| Topological Polar Surface Area | 67.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 157.1215 |
| Heavy Atoms | 11 |
| Complexity | 163.06862 |
Chemical Identifiers
| CAS Number | 14066-72-9 |
|---|---|
| SMILES | CC(C)CC(=NNC(=O)N)C |
Product Overview
1-(4-Methyl-2-pentylidene)semicarbazide (CAS 14066-72-9), with molecular formula C7H15N3O and molecular weight 157.12 g/mol. IUPAC: (4-methylpentan-2-ylideneamino)urea.
Chemical Property Profile of 1-(4-Methyl-2-pentylidene)semicarbazide
Property Insights of 1-(4-Methyl-2-pentylidene)semicarbazide
The XLogP value of 1.0767 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Methyl-2-pentylidene)semicarbazide. The TPSA of 67.48 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Methyl-2-pentylidene)semicarbazide. Following Lipinski's Rule of Five, 1-(4-Methyl-2-pentylidene)semicarbazide has 2 hydrogen bond donor(s) and 2 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-(4-Methyl-2-pentylidene)semicarbazide?
The CAS number of 1-(4-Methyl-2-pentylidene)semicarbazide is 14066-72-9.
What is the molecular formula of 1-(4-Methyl-2-pentylidene)semicarbazide?
The molecular formula of 1-(4-Methyl-2-pentylidene)semicarbazide is C7H15N3O.
What is the molecular weight of 1-(4-Methyl-2-pentylidene)semicarbazide?
The molecular weight of 1-(4-Methyl-2-pentylidene)semicarbazide is 157.12 g/mol.
Where can I buy 1-(4-Methyl-2-pentylidene)semicarbazide?
You can request a quote for 1-(4-Methyl-2-pentylidene)semicarbazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Methyl-2-pentylidene)semicarbazide?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Methyl-2-pentylidene)semicarbazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.