N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin
TL;DR: N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin (CAS 117961-27-0) is a chemical compound with molecular formula C30H37N7O7S and molecular weight 639.2475 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[5-(diaminomethylideneamino)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]-1-[2-[(4-methylphenyl)sulfonylamino]acetyl]pyrrolidine-2-carboxamide
Also Known As: N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin, N-4-Tosyl-glycyl-L-prolyl-L-arginine 7-amido-4-methylcoumarin hydrochloride, N-[5-(diaminomethylideneamino)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]-1-[2-[(4-methylphenyl)sulfonylamino]acetyl]pyrrolidine-2-carboxamide
Technical Specifications
| Molecular Formula | C30H37N7O7S |
| Molecular Weight | 639.2475 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 224.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 639.2475 Da |
| Heavy Atoms | 45 |
| Complexity | 1270.0 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCC(=O)N2CCCC2C(=O)NC(CCCN=C(N)N)C(=O)NC3=CC4=C(C=C3)C(=CC(=O)O4)C |
| InChIKey | DWTAHKFEIVWFGQ-UHFFFAOYSA-N |
Chemical Property Profile of N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin
Property Insights of N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin. The TPSA of 224.0 Ų indicates high polarity, suggesting N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin has 5 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin?
The CAS number of N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin is 117961-27-0.
What is the molecular formula of N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin?
The molecular formula of N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin is C30H37N7O7S.
What is the molecular weight of N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin?
The molecular weight of N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin is 639.2475 g/mol.
Where can I buy N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin?
You can request a quote for N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin?
Yes, CoreyChem provides custom synthesis services for N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.