[email protected]
CAS 1369534-61-1 (R)-2-(1-(TERT-BUTOXYCARBONYL)AZETIDIN-2-YL)ACETIC ACID molecular structure lightbox
CAS RN: 1369534-61-1

(R)-2-(1-(TERT-BUTOXYCARBONYL)AZETIDIN-2-YL)ACETIC ACID

Product Availability

Choose a grade to view its available package options.

4 package records3 with current stock1 grade group
Batch No.PackageAvailabilityWarehouseLead TimeInquiry
Batchno.20250816 100mg In stock Shanghai Inquiry
Batchno.20250511 1g In stock Shanghai Inquiry
Batchno.20250112 250mg In stock Shanghai Inquiry
Batchno.20250215 25mg Out of stock 8-10 business days Inquiry
  • Product code: starshine_CAS1369534-61-1
  • Purity/Analytical Methods: >99.0%
GET A QUOTE

1369534-61-1 / 2-[(2R)-1-[(2-methylpropan-2-yl)oxycarbonyl]azetidin-2-yl]acetic acid

Standard CAS: 1369534-61-1 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1369534-61-1
Multi CAS
No
Molecular Formula
C10H17NO4
Molecular Weight
215.250000
Exact Mass
215.115758
SMILES
CC(C)(C)OC(=O)N1CC[C@@H]1CC(=O)O
InChI
InChI=1S/C10H17NO4/c1-10(2,3)15-9(14)11-5-4-7(11)6-8(12)13/h7H,4-6H2,1-3H3,(H,12,13)/t7-/m1/s1
InChIKey
TXLPFPLPMZEOQB-SSDOTTSWSA-N

Computed Properties

Structural Parameters

Heavy atom count
15
Fraction Csp3
0.8
Rotatable bonds
2
H-bond acceptors
3
H-bond donors
1
Molar refractivity
53.6
TPSA
66.84

LogP / Solubility

WLOGP
1.47
MLOGP
1.3
XLogP3
0.8
Consensus LogP
1.19
Log S (ESOL)
-1.97
Class (ESOL)
Soluble
Log S (Ali)
-2.39
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.52
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)
-2.99

Drug-likeness / Medicinal Chemistry

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

Customers Also Viewed

Get In Touch

Contact Us