TL;DR: methyl N-[(3-methoxyphenyl)carbamoyl]-D-methioninate (CAS 1173667-11-2) is a chemical compound with molecular formula C14H20N2O4S and molecular weight 312.11438 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (2R)-2-[(3-methoxyphenyl)carbamoylamino]-4-methylsulfanylbutanoate
Also Known As: methyl N-[(3-methoxyphenyl)carbamoyl]-D-methioninate, (R)-methyl 2-(3-(3-methoxyphenyl)ureido)-4-(methylthio)butanoate, methyl (2R)-2-[(3-methoxyphenyl)carbamoylamino]-4-methylsulfanylbutanoate
| Molecular Formula | C14H20N2O4S |
| Molecular Weight | 312.11438 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 312.11438 Da |
| Heavy Atoms | 21 |
| Complexity | 341.0 |
| SMILES | COC1=CC=CC(=C1)NC(=O)N[C@H](CCSC)C(=O)OC |
| InChIKey | LVHUBROGEBVBLK-GFCCVEGCSA-N |
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl N-[(3-methoxyphenyl)carbamoyl]-D-methioninate. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-[(3-methoxyphenyl)carbamoyl]-D-methioninate. Following Lipinski's Rule of Five, methyl N-[(3-methoxyphenyl)carbamoyl]-D-methioninate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of methyl N-[(3-methoxyphenyl)carbamoyl]-D-methioninate is 1173667-11-2.
The molecular formula of methyl N-[(3-methoxyphenyl)carbamoyl]-D-methioninate is C14H20N2O4S.
The molecular weight of methyl N-[(3-methoxyphenyl)carbamoyl]-D-methioninate is 312.11438 g/mol.
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