![methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate structure](/static/products/117/1173685-99-8.webp)
methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate
TL;DR: methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate (CAS 1173685-99-8) is a chemical compound with molecular formula C20H22N4O4 and molecular weight 382.1641 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (2S)-4-methyl-2-[(2-pyridin-3-yl-1,3-benzoxazol-5-yl)carbamoylamino]pentanoate
Also Known As: AB01298934-01, methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate, (S)-methyl 4-methyl-2-(3-(2-(pyridin-3-yl)benzo[d]oxazol-5-yl)ureido)pentanoate
Technical Specifications
| Molecular Formula | C20H22N4O4 |
| Molecular Weight | 382.1641 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 106.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 382.1641 Da |
| Heavy Atoms | 28 |
| Complexity | 544.0 |
| SMILES | CC(C)C[C@@H](C(=O)OC)NC(=O)NC1=CC2=C(C=C1)OC(=N2)C3=CN=CC=C3 |
| InChIKey | IAJBOSCQSGWREO-INIZCTEOSA-N |
Chemical Property Profile of methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate
Property Insights of methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate
The XLogP value of 3.0 indicates that methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate. Following Lipinski's Rule of Five, methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate has 2 hydrogen bond donor(s) and 6 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 N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate?
The CAS number of methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate is 1173685-99-8.
What is the molecular formula of methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate?
The molecular formula of methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate is C20H22N4O4.
What is the molecular weight of methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate?
The molecular weight of methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate is 382.1641 g/mol.
Where can I buy methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate?
You can request a quote for methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate?
Yes, CoreyChem provides custom synthesis services for methyl N-{[2-(pyridin-3-yl)-1,3-benzoxazol-5-yl]carbamoyl}-L-leucinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.