tert-butyl 5-(ethylamino)-4-[({5-[4-(2-fluoro-5-{[(2-fluoro-5-methylphenyl)amino]carbonyl}phenoxy)pyridin-2-yl]-1H-pyrrol-3-yl}carbonyl)amino]-5-oxopentanoate
Basic information
- Standard SMILES
CCNC(=O)C(CCC(=O)OC(C)(C)C)NC(=O)c1c[nH]c(-c2cc(Oc3cc(C(=O)Nc4cc(C)ccc4F)ccc3F)ccn2)c1- InChIKey
GHVQVFHWRVNPOG-UHFFFAOYSA-N- Molecular formula
- C35H37F2N5O6
- Average molar mass
- 661.7 g/mol
Names & identifiers
- Preferred name
- tert-butyl 5-(ethylamino)-4-[({5-[4-(2-fluoro-5-{[(2-fluoro-5-methylphenyl)amino]carbonyl}phenoxy)pyridin-2-yl]-1H-pyrrol-3-yl}carbonyl)amino]-5-oxopentanoate
- IUPAC
- tert-butyl 5-(ethylamino)-4-[[5-[4-[2-fluoro-5-[(2-fluoro-5-methylphenyl)carbamoyl]phenoxy]-2-pyridinyl]-1H-pyrrole-3-carbonyl]amino]-5-oxopentanoate
Names & synonyms
SCHEMBL14760629GHVQVFHWRVNPOG-UHFFFAOYSA-Ntert-butyl 5-(ethylamino)-4-[({5-[4-(2-fluoro-5-{[(2-fluoro-5-methylphenyl)amino]carbonyl}phenoxy)pyridin-2-yl]-1H-pyrrol-3-yl}carbonyl)amino]-5-oxopentanoate
Database identifiers
- PubChem CID
- 71293530
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 152 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 14
- Heavy atoms
- 48
- Formal charge
- 0
- Complexity
- 1,110
Related reactions
2 records
Compound notes
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