![(S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid structure](/static/products/956/956382-85-7.png)
(S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid
TL;DR: (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid (CAS 956382-85-7) is a chemical compound with molecular formula C25H29N3O7 and molecular weight 483.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-5-(carbamoylamino)-2-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]pentanoic acid
Also Known As: (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid, (2S)-5-(carbamoylamino)-2-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]pentanoic acid, N~5~-carbamoyl-N~2~-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]-L-ornithine
| Molecular Formula | C25H29N3O7 |
|---|---|
| Molecular Weight | 483.20 g/mol |
| LogP | 2.67692 |
| Topological Polar Surface Area | 164.87 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 483.20056 |
| Heavy Atoms | 35 |
| Complexity | 1354.8293 |
Chemical Identifiers
| CAS Number | 956382-85-7 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=CC3=C(C=C12)C4=C(O3)CCCC4)CCC(=O)N[C@@H](CCCNC(=O)N)C(=O)O |
Product Overview
(S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid (CAS 956382-85-7), with molecular formula C25H29N3O7 and molecular weight 483.20 g/mol. IUPAC: (2S)-5-(carbamoylamino)-2-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-[1]benzofuro[3,2-g]chromen-3-yl)propanoylamino]pentanoic acid.
Chemical Property Profile of (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid
Property Insights of (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid
The XLogP value of 2.67692 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid. The TPSA of 164.87 Ų indicates high polarity, suggesting (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid?
The CAS number of (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid is 956382-85-7.
What is the molecular formula of (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid?
The molecular formula of (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid is C25H29N3O7.
What is the molecular weight of (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid?
The molecular weight of (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid is 483.20 g/mol.
Where can I buy (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid?
You can request a quote for (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (S)-2-(3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-benzofuro[3,2-g]chromen-3-yl)propanamido)-5-ureidopentanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.