[(1R,3S,4S,7S,8S,9S)-9-bromo-7,11-dimethoxy-12-methyl-10,13-dioxo-2,6-diazapentacyclo[7.4.0.0¹,⁶.0²,⁴.0³,⁷]tridec-11-en-8-yl]methyl carbamate | C16H18BrN3O6 | COC1=C(C)C(=O)[C@@]23N4[C@H]5CN2[C@@](OC)([C@@H]45)[C@H](COC(N)=O)[C@@]3(Br)C1=O | 132830-44-5, B679360 | Chemspace

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Home CSCS06359897149

Structure Info

Chemspace ID: CSCS06359897149 (Synthesis)

IUPAC Name: [(1R,3S,4S,7S,8S,9S)-9-bromo-7,11-dimethoxy-12-methyl-10,13-dioxo-2,6-diazapentacyclo[7.4.0.0¹,⁶.0²,⁴.0³,⁷]tridec-11-en-8-yl]methyl carbamate

Mol formula: C₁₆H₁₈BrN₃O₆

Mol weight: 428 Da

Catalog Number(s): 132830-44-5, B679360

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Properties
SDS

Properties

LogP: 1.46

Heavy atoms count: 26

Rotatable bond count: 5

Number of rings: 5

Carbon bond saturation, Fsp3: 0.687

Polar surface area (Å): 111

Hydrogen bond acceptors count: 7

Hydrogen bond donors count: 1

: Zoom the structure; CSCS06359897149

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Description: CAS: 132830-44-5

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