Cenu-lex-2
TL;DR: Cenu-lex-2 (CAS 127794-31-4) is a chemical compound with molecular formula C21H29ClN8O5 and molecular weight 508.19495 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[3-[[2-chloroethyl(nitroso)carbamoyl]amino]propanoylamino]-1-methyl-N-[1-methyl-5-(propylcarbamoyl)pyrrol-3-yl]pyrrole-2-carboxamide
Also Known As: Cenu-lex-2, 4-[3-[[2-chloroethyl(nitroso)carbamoyl]amino]propanoylamino]-1-methyl-N-[1-methyl-5-(propylcarbamoyl)pyrrol-3-yl]pyrrole-2-carboxamide, 1-(2-Chloroethyl)-1-nitroso-3-[3-[[1-methyl-5-[(1-methyl-5-propylcarbamoyl-1H-pyrrol-3-yl)carbamoyl]-1H-pyrrol-3-yl]amino]-3-oxopropyl]urea, 4-({N-[(2-Chloroethyl)(nitroso)carbamoyl]-beta-alanyl}amino)-1-methyl-N-[1-methyl-5-(propylcarbamoyl)-1H-pyrrol-3-yl]-1H-pyrrole-2-carboxamide, 4-[4-(3-{[N-(2-chloroethyl)-N'-oxohydrazinecarbonyl]amino}propanamido)-1-methyl-1H-pyrrole-2-amido]-1-methyl-N-propyl-1H-pyrrole-2-carboxamide
Technical Specifications
| Molecular Formula | C21H29ClN8O5 |
| Molecular Weight | 508.19495 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 159.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 508.19495 Da |
| Heavy Atoms | 35 |
| Complexity | 772.0 |
| SMILES | CCCNC(=O)C1=CC(=CN1C)NC(=O)C2=CC(=CN2C)NC(=O)CCNC(=O)N(CCCl)N=O |
| InChIKey | ZSSSWJLAVLOLAB-UHFFFAOYSA-N |
Chemical Property Profile of Cenu-lex-2
Property Insights of Cenu-lex-2
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cenu-lex-2. The TPSA of 159.0 Ų indicates high polarity, suggesting Cenu-lex-2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Cenu-lex-2 has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Cenu-lex-2?
The CAS number of Cenu-lex-2 is 127794-31-4.
What is the molecular formula of Cenu-lex-2?
The molecular formula of Cenu-lex-2 is C21H29ClN8O5.
What is the molecular weight of Cenu-lex-2?
The molecular weight of Cenu-lex-2 is 508.19495 g/mol.
Where can I buy Cenu-lex-2?
You can request a quote for Cenu-lex-2 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cenu-lex-2?
Yes, CoreyChem provides custom synthesis services for Cenu-lex-2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.