N-methyl-N'-phenyl-N'-methyl-N-nitrosourea
TL;DR: N-methyl-N'-phenyl-N'-methyl-N-nitrosourea (CAS 72586-68-6) is a chemical compound with molecular formula C9H11N3O2 and molecular weight 193.08513 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3-dimethyl-1-nitroso-3-phenylurea
Also Known As: DMPNU, 1,3-dimethyl-1-nitroso-3-phenylurea, 1,3-Dimethyl-3-phenyl-1-nitrosourea, N-Methyl-N'-phenyl-N'-methyl-N-nitrosourea, N,N'-Dimethyl-N-nitroso-N'-phenylurea
Technical Specifications
| Molecular Formula | C9H11N3O2 |
| Molecular Weight | 193.08513 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 53.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.08513 Da |
| Heavy Atoms | 14 |
| Complexity | 214.0 |
| SMILES | CN(C1=CC=CC=C1)C(=O)N(C)N=O |
| InChIKey | KCMWTOXURHICRN-UHFFFAOYSA-N |
Chemical Property Profile of N-methyl-N'-phenyl-N'-methyl-N-nitrosourea
Property Insights of N-methyl-N'-phenyl-N'-methyl-N-nitrosourea
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-methyl-N'-phenyl-N'-methyl-N-nitrosourea. With a topological polar surface area (TPSA) of 53.0 Ų, N-methyl-N'-phenyl-N'-methyl-N-nitrosourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-methyl-N'-phenyl-N'-methyl-N-nitrosourea has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-methyl-N'-phenyl-N'-methyl-N-nitrosourea?
The CAS number of N-methyl-N'-phenyl-N'-methyl-N-nitrosourea is 72586-68-6.
What is the molecular formula of N-methyl-N'-phenyl-N'-methyl-N-nitrosourea?
The molecular formula of N-methyl-N'-phenyl-N'-methyl-N-nitrosourea is C9H11N3O2.
What is the molecular weight of N-methyl-N'-phenyl-N'-methyl-N-nitrosourea?
The molecular weight of N-methyl-N'-phenyl-N'-methyl-N-nitrosourea is 193.08513 g/mol.
Where can I buy N-methyl-N'-phenyl-N'-methyl-N-nitrosourea?
You can request a quote for N-methyl-N'-phenyl-N'-methyl-N-nitrosourea directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-methyl-N'-phenyl-N'-methyl-N-nitrosourea?
Yes, CoreyChem provides custom synthesis services for N-methyl-N'-phenyl-N'-methyl-N-nitrosourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.