YM 47142
TL;DR: YM 47142 (CAS 157951-40-1) is a chemical compound with molecular formula C43H64N8O13 and molecular weight 900.4593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(2S)-1-[[(2S,3R)-1-[[(3R,6S,9S,14S,17S,18R)-6-(2-amino-2-oxoethyl)-3,18-dimethyl-9,14-bis(2-methylpropyl)-2,5,8,11,12,13,16-heptaoxo-1-oxa-4,7,10,15-tetrazacyclooctadec-17-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-3-methylbutanamide
Also Known As: YM 47142, N-(3-methylbutanoyl)-L-phenylalanyl-N-[(3R,6S,9S,14S,17S,18R)-6-(2-amino-2-oxoethyl)-3,18-dimethyl-9,14-bis(2-methylpropyl)-2,5,8,11,12,13,16-heptaoxo-1-oxa-4,7,10,15-tetraazacyclooctadecan-17-yl]-L-threoninamide, N-[(2S)-1-[[(2S,3R)-1-[[(3R,6S,9S,14S,17S,18R)-6-(2-amino-2-oxoethyl)-3,18-dimethyl-9,14-bis(2-methylpropyl)-2,5,8,11,12,13,16-heptaoxo-1-oxa-4,7,10,15-tetrazacyclooctadec-17-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-3-methylbutanamide
Technical Specifications
| Molecular Formula | C43H64N8O13 |
| Molecular Weight | 900.4593 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 327.0 Ų |
| Hydrogen Bond Donors | 9 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 16 |
| Exact Mass | 900.4593 Da |
| Heavy Atoms | 64 |
| Complexity | 1730.0 |
| SMILES | C[C@@H]1[C@@H](C(=O)N[C@H](C(=O)C(=O)C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](C(=O)O1)C)CC(=O)N)CC(C)C)CC(C)C)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)CC(C)C |
| InChIKey | WDOYVAJHZHVZQI-KNFAUAPHSA-N |
Chemical Property Profile of YM 47142
Property Insights of YM 47142
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for YM 47142. The TPSA of 327.0 Ų indicates high polarity, suggesting YM 47142 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, YM 47142 has 9 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of YM 47142?
The CAS number of YM 47142 is 157951-40-1.
What is the molecular formula of YM 47142?
The molecular formula of YM 47142 is C43H64N8O13.
What is the molecular weight of YM 47142?
The molecular weight of YM 47142 is 900.4593 g/mol.
Where can I buy YM 47142?
You can request a quote for YM 47142 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for YM 47142?
Yes, CoreyChem provides custom synthesis services for YM 47142 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.