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CAS 1932378-34-1 Cyclopropanecarboxylic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, (1R,2R)- molecular structure lightbox
CAS RN: 1932378-34-1

Cyclopropanecarboxylic acid, 2-[[(1,1-dimethylethoxy)carbonyl]amino]-, methyl ester, (1R,2R)-

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Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20250412 100mg / 500mg Out of stock 15 business days Inquiry
  • Product code: starshine_CAS1932378-34-1
  • Purity/Analytical Methods: >99.0%
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1932378-34-1 / trans-methyl (1R,2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]cyclopropane-1-carboxylate

Standard CAS: 1932378-34-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1932378-34-1
Multi CAS
No
Molecular Formula
C10H17NO4
Molecular Weight
215.250000
Exact Mass
215.115758
SMILES
CC(C)(C)OC(=O)N[C@@H]1C[C@H]1C(=O)OC
InChI
InChI=1S/C10H17NO4/c1-10(2,3)15-9(13)11-7-5-6(7)8(12)14-4/h6-7H,5H2,1-4H3,(H,11,13)/t6-,7-/m1/s1
InChIKey
JYDFYTQQOAHATE-RNFRBKRXSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
0.8
Rotatable bonds
2
H-bond acceptors
4
H-bond donors
1
Molar refractivity
53.28
TPSA
64.63

LogP / Solubility

WLOGP
1.07
MLOGP
0.95
XLogP3
1.5
Consensus LogP
1.17
Log S (ESOL)
-1.72
Class (ESOL)
Soluble
Log S (Ali)
-2.1
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.19
Class (SILICOS-IT)
Moderately soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.27

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5

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