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CAS 1286768-31-7 Morpholine, 2-(1-Methylethyl)-, (2S)- molecular structure lightbox
CAS RN: 1286768-31-7

Morpholine, 2-(1-Methylethyl)-, (2S)-

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5 package records4 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250503 100mg In stock Shanghai, Shenzhen Inquiry
Batchno.20250729 100mg / 250mg / 1g / 5g Out of stock 8-10 business days Inquiry
Batchno.20260119 1g In stock Shanghai, Tianjin Inquiry
Batchno.20260424 250mg In stock Shanghai, Shenzhen, Tianjin Inquiry
Batchno.20250502 5g In stock Shanghai Inquiry
  • Product code: starshine_CAS1286768-31-7
  • Purity/Analytical Methods: >99.0%
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1286768-31-7 / (2S)-2-propan-2-ylmorpholine

Standard CAS: 1286768-31-7 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1286768-31-7
Multi CAS
No
Molecular Formula
C7H15NO
Molecular Weight
129.200000
Exact Mass
129.115364
SMILES
CC(C)[C@H]1CNCCO1
InChI
InChI=1S/C7H15NO/c1-6(2)7-5-8-3-4-9-7/h6-8H,3-5H2,1-2H3/t7-/m1/s1
InChIKey
DNBOOEPFXFVICE-SSDOTTSWSA-N

Computed Properties

Structural Parameters

Heavy atom count
9
Fraction Csp3
1
Rotatable bonds
1
H-bond acceptors
2
H-bond donors
1
Molar refractivity
37.45
TPSA
21.26

LogP / Solubility

WLOGP
0.63
MLOGP
0.55
XLogP3
0.8
Consensus LogP
0.66
Log S (ESOL)
-0.97
Class (ESOL)
Very soluble
Log S (Ali)
-1.07
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.14
Class (SILICOS-IT)
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)
-3.06

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2

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