N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide
TL;DR: N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide (CAS 76291-40-2) is a chemical compound with molecular formula C11H15N3O2S and molecular weight 253.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide
Also Known As: N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide
| Molecular Formula | C11H15N3O2S |
|---|---|
| Molecular Weight | 253.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 79.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 253.0885 |
| Heavy Atoms | 17 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 76291-40-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N=CNN=C(C)C |
| InChIKey | XYAWPNNRKSLQDP-UHFFFAOYSA-N |
Product Overview
N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide (CAS 76291-40-2), with molecular formula C11H15N3O2S and molecular weight 253.09 g/mol. IUPAC: N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide.
Chemical Property Profile of N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide
Property Insights of N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide. The TPSA of 79.3 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide. Following Lipinski's Rule of Five, N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide has 1 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 N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide?
The CAS number of N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide is 76291-40-2.
What is the molecular formula of N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide?
The molecular formula of N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide is C11H15N3O2S.
What is the molecular weight of N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide?
The molecular weight of N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide is 253.09 g/mol.
Where can I buy N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide?
You can request a quote for N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide?
Yes, KEHONG BIO provides custom synthesis services for N'-(4-methylphenyl)sulfonyl-N-(propan-2-ylideneamino)methanimidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.