ocp-9-176
TL;DR: ocp-9-176 (CAS 106036-65-1) is a chemical compound with molecular formula C24H26N6O8S2 and molecular weight 590.12537 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4S,6R,7S)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(2-carboxypropan-2-yloxyimino)acetyl]amino]-4-methyl-3-[(1-methylpyridin-1-ium-4-yl)sulfanylmethyl]-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate
Also Known As: ocp-9-176, L 656575, L-656575, (4S,6R,7S)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-(2-carboxypropan-2-yloxyimino)acetyl]amino]-4-methyl-3-[(1-methylpyridin-1-ium-4-yl)sulfanylmethyl]-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylate, 4-({[(4S,6R,7S)-7-[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-[(1-carboxy-1-methylethoxy)imino]acetamido]-2-carboxylato-4-methyl-8-oxo-5-oxa-1-azabicyclo[4.2.0]oct-2-en-3-yl]methyl}sulfanyl)-1-methylpyridin-1-ium
Technical Specifications
| Molecular Formula | C24H26N6O8S2 |
| Molecular Weight | 590.12537 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 254.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 9 |
| Exact Mass | 590.12537 Da |
| Heavy Atoms | 40 |
| Complexity | 1100.0 |
| SMILES | C[C@H]1C(=C(N2[C@H](O1)[C@@H](C2=O)NC(=O)/C(=N\OC(C)(C)C(=O)O)/C3=CSC(=N3)N)C(=O)[O-])CSC4=CC=[N+](C=C4)C |
| InChIKey | AXPAGQFNDQXHIX-LSBPFWFBSA-N |
Chemical Property Profile of ocp-9-176
Property Insights of ocp-9-176
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ocp-9-176. The TPSA of 254.0 Ų indicates high polarity, suggesting ocp-9-176 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, ocp-9-176 has 3 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 ocp-9-176?
The CAS number of ocp-9-176 is 106036-65-1.
What is the molecular formula of ocp-9-176?
The molecular formula of ocp-9-176 is C24H26N6O8S2.
What is the molecular weight of ocp-9-176?
The molecular weight of ocp-9-176 is 590.12537 g/mol.
Where can I buy ocp-9-176?
You can request a quote for ocp-9-176 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for ocp-9-176?
Yes, CoreyChem provides custom synthesis services for ocp-9-176 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.