N0001-013354
TL;DR: N0001-013354 (CAS 221076-20-6) is a chemical compound with molecular formula C30H37N3O10 and molecular weight 599.2479 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(carboxymethoxy)-5-[(2S)-2-[[(2S)-2-(3-carboxypropanoylamino)-3-phenylpropanoyl]amino]-3-oxo-3-(pentylamino)propyl]benzoic acid
2-(carboxymethoxy)-5-[2-[[2-(3-carboxypropanoylamino)-3-phenylpropanoyl]amino]-3-oxo-3-(pentylamino)propyl]benzoic acid
Also Known As: N0001-013354, 2-(carboxymethoxy)-5-[(2S)-2-[[(2S)-2-(3-carboxypropanoylamino)-3-phenylpropanoyl]amino]-3-oxo-3-(pentylamino)propyl]benzoic acid, 2-(Carboxymethoxy)-5-[2-[[2-(3-carboxypropanoylamino)-3-phenylpropanoyl]amino]-3-oxo-3-(pentylamino)propyl]benzoic acid, 2-(carboxymethyloxy)-5-[2-[[2-[(4-hydroxy-4-oxobutanoyl)amino]-3-phenylpropanoyl]amino]-3-oxo-3-(pentylamino)propyl]benzoic acid, INX
Technical Specifications
| Molecular Formula | C30H37N3O10 |
| Molecular Weight | 599.2479 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 208.0 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 19 |
| Exact Mass | 599.2479 Da |
| Heavy Atoms | 43 |
| Complexity | 952.0 |
| SMILES | CCCCCNC(=O)C(CC1=CC(=C(C=C1)OCC(=O)O)C(=O)O)NC(=O)C(CC2=CC=CC=C2)NC(=O)CCC(=O)O |
| InChIKey | PUAJYWYRZTYQKS-UHFFFAOYSA-N |
Chemical Property Profile of N0001-013354
Property Insights of N0001-013354
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N0001-013354. The TPSA of 208.0 Ų indicates high polarity, suggesting N0001-013354 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N0001-013354 has 6 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of N0001-013354?
The CAS number of N0001-013354 is 221076-20-6.
What is the molecular formula of N0001-013354?
The molecular formula of N0001-013354 is C30H37N3O10.
What is the molecular weight of N0001-013354?
The molecular weight of N0001-013354 is 599.2479 g/mol.
Where can I buy N0001-013354?
You can request a quote for N0001-013354 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N0001-013354?
Yes, CoreyChem provides custom synthesis services for N0001-013354 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.