![methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate structure](/static/products/117/1173682-31-9.webp)
methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate
TL;DR: methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate (CAS 1173682-31-9) is a chemical compound with molecular formula C15H20N2O5 and molecular weight 308.1372 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 4-[[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoylamino]benzoate
Also Known As: (S)-methyl 4-(3-(1-methoxy-3-methyl-1-oxobutan-2-yl)ureido)benzoate, methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate, methyl 4-[[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoylamino]benzoate
Technical Specifications
| Molecular Formula | C15H20N2O5 |
| Molecular Weight | 308.1372 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 93.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 308.1372 Da |
| Heavy Atoms | 22 |
| Complexity | 403.0 |
| SMILES | CC(C)[C@@H](C(=O)OC)NC(=O)NC1=CC=C(C=C1)C(=O)OC |
| InChIKey | ZQVJXEONDPJJGE-LBPRGKRZSA-N |
Chemical Property Profile of methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate
Property Insights of methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate. The TPSA of 93.7 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate. Following Lipinski's Rule of Five, methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate?
The CAS number of methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate is 1173682-31-9.
What is the molecular formula of methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate?
The molecular formula of methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate is C15H20N2O5.
What is the molecular weight of methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate?
The molecular weight of methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate is 308.1372 g/mol.
Where can I buy methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate?
You can request a quote for methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate?
Yes, CoreyChem provides custom synthesis services for methyl 4-({[(2S)-1-methoxy-3-methyl-1-oxobutan-2-yl]carbamoyl}amino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.