N-Carboethoxy-N-[(2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl]-(L)-valine benzyl ester

Base Information

• Chemical Name: N-Carboethoxy-N-[(2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl]-(L)-valine benzyl ester
• CAS No.: 137864-56-3
• Molecular Formula: C29H31N5O4
• DSSTox Substance ID: DTXSID801111747

Synonyms:SCHEMBL2482;SONICSJAIWPRCA-SANMLTNESA-N;DTXSID801111747;N-Carboethoxy-N-[(2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl]-(L)-valine benzyl ester;137864-56-3;L-Valine, N-(ethoxycarbonyl)-N-[[2'-(1H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]-, phenylmethyl ester

Chemical Property of N-Carboethoxy-N-[(2'-(1H-tetrazol-5-yl)biphenyl-4-yl)methyl]-(L)-valine benzyl ester

Chemical Property:

• XLogP3: 5.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 12
• Exact Mass: 513.23760449
• Heavy Atom Count: 38
• Complexity: 739

Purity/Quality:

99% ^*data from raw suppliers

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Useful:

• Canonical SMILES: CCOC(=O)N(CC1=CC=C(C=C1)C2=CC=CC=C2C3=NNN=N3)C(C(C)C)C(=O)OCC4=CC=CC=C4
• Isomeric SMILES: CCOC(=O)N(CC1=CC=C(C=C1)C2=CC=CC=C2C3=NNN=N3)[C@@H](C(C)C)C(=O)OCC4=CC=CC=C4

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