(2-{4-[3-Methyl-4-(6-methyl-pyridin-3-yloxy)-phenylamino]-quinazolin-6-ylcarbamoyl}-ethyl)-carbamic acid t-butylester

HCID 11699363
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Basic information

Standard SMILES
Cc1ccc(Oc2ccc(Nc3ncnc4ccc(NC(=O)CCNC(=O)OC(C)(C)C)cc34)cc2C)cn1
InChIKey
JRTGOVYGXKLFDW-UHFFFAOYSA-N
Molecular formula
C29H32N6O4
Average molar mass
528.6 g/mol
Monoisotopic mass
528.24850352

Names & identifiers

Preferred name
(2-{4-[3-Methyl-4-(6-methyl-pyridin-3-yloxy)-phenylamino]-quinazolin-6-ylcarbamoyl}-ethyl)-carbamic acid t-butylester
IUPAC
tert-butyl N-[3-[[4-[3-methyl-4-[(6-methyl-3-pyridinyl)oxy]anilino]quinazolin-6-yl]amino]-3-oxopropyl]carbamate

Names & synonyms

JRTGOVYGXKLFDW-UHFFFAOYSA-N(2-{4-[3-methyl-4-(6-methyl-pyridin-3-yloxy)-phenylamino]-quinazolin-6-ylcarbamoyl}-ethyl)-carbamic acid t-butylester

Database identifiers

PubChem CID
11699363

Properties

Computed structural properties

XLogP
4.5
Topological polar surface area
127 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
8
Rotatable bonds
10
Heavy atoms
39

Related reactions

2 records
New reaction record

Compound notes

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