(1S)-16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-2,4(8),9,15(20),16,18-hexaene

CAS: 5096-57-1

Molecular Formula	`C20H21NO4`
Molecular Weight	339.4 g/mol
LogP	3.1
Topological Polar Surface Area	40.2 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	2
Exact Mass	339.14706
Heavy Atoms	25
Complexity	488.0

Chemical Identifiers

CAS Number	5096-57-1
SMILES	`COC1=C(C2=C(CC3C4=CC5=C(C=C4CCN3C2)OCO5)C=C1)OC`
InChIKey	`VZTUIEROBZXUFA-INIZCTEOSA-N`

📖 Product Overview

(1S)-16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-2,4(8),9,15(20),16,18-hexaene (CAS: 5096-57-1) is a chemical compound with molecular formula C20H21NO4 and molecular weight 339.4 g/mol. Its IUPAC systematic name is (1S)-16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-2,4(8),9,15(20),16,18-hexaene. LogP 3.1 Topological Polar Surface Area 40.2 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 2 Exact Mass 339.14706 Heavy Atoms 25 Complexity 488.0 InChI Key: VZTUIEROBZXUFA-INIZCTEOSA-N. SMILES: COC1=C(C2=C(CC3C4=CC5=C(C=C4CCN3C2)OCO5)C=C1)OC.

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Multi-source research profile: chemical properties, regulatory status, and sourcing guide for (1S)-16,17-dimethoxy-5,7-dioxa-13-azapentacyclo[11.8.0.02,10.04,8.015,20]henicosa-2,4(8),9,15(20),16,18-hexaene.

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