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7-[2,5-Dioxo-4-(7-triisopropylsilanyloxymethyl-1H-indol-3-yl)-2,5-dihydro-1H-pyrrol-3-yl]-3,4-dihydro-1H-[1,4]diazepino[6,7,1-hi]indole-2-carboxylic Acid Tert-Butyl Ester

HCID 69743447
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Basic information

Standard SMILES
CC(C)[Si](OCc1cccc2c(C3=C(c4ccc5c6c4ccn6CC(C(=O)OC(C)(C)C)NC5)C(=O)NC3=O)c[nH]c12)(C(C)C)C(C)C
InChIKey
NFGYELZXFLYHFZ-UHFFFAOYSA-N
Molecular formula
C38H48N4O5Si
Average molar mass
668.9 g/mol

Names & identifiers

Preferred name
7-[2,5-Dioxo-4-(7-triisopropylsilanyloxymethyl-1H-indol-3-yl)-2,5-dihydro-1H-pyrrol-3-yl]-3,4-dihydro-1H-[1,4]diazepino[6,7,1-hi]indole-2-carboxylic Acid Tert-Butyl Ester
IUPAC
tert-butyl 5-[2,5-dioxo-4-[7-[tri(propan-2-yl)silyloxymethyl]-1H-indol-3-yl]pyrrol-3-yl]-1,10-diazatricyclo[6.4.1.04,13]trideca-2,4,6,8(13)-tetraene-11-carboxylate

Names & synonyms

SCHEMBL6327468NFGYELZXFLYHFZ-UHFFFAOYSA-N7-[2,5-Dioxo-4-(7-triisopropylsilanyloxymethyl-1H-indol-3-yl)-2,5-dihydro-1H-pyrrol-3-yl]-3,4-dihydro-1H-[1,4]diazepino[6,7,1-hi]indole-2-carboxylic Acid Tert-Butyl Ester

Database identifiers

PubChem CID
69743447

Properties

Computed structural propertiesFilling in

Topological polar surface area
114 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
11
Heavy atoms
48
Formal charge
0
Complexity
1,250

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Related reactions

1 records
New reaction record
HRID 984003 reaction equation
HRID 984003As productuspto-grants-2005_03

Compound notes

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