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 639.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
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
| Molecular Formula | C30H37N7O7S |
|---|---|
| Molecular Weight | 639.25 g/mol |
| LogP | 0.85624 |
| Topological Polar Surface Area | 219.29 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 12 |
| Exact Mass | 639.2475 |
| Heavy Atoms | 45 |
| Complexity | 1767.3846 |
Chemical Identifiers
| CAS Number | 117961-27-0 |
|---|---|
| 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 |
Product Overview
N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin (CAS 117961-27-0), with molecular formula C30H37N7O7S and molecular weight 639.25 g/mol. IUPAC: N-[5-(diaminomethylideneamino)-1-[(4-methyl-2-oxochromen-7-yl)amino]-1-oxopentan-2-yl]-1-[2-[(4-methylphenyl)sulfonylamino]acetyl]pyrrolidine-2-carboxamide.
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 0.85624 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin. The TPSA of 219.29 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 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
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 639.25 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 KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-p-tosyl-gly-pro-arg-7-amido-4-methylcoumarin?
Yes, KEHONG BIO 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.