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CAS 1389890-72-5 (1R)-6-hydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid molecular structure lightbox
CAS RN: 1389890-72-5

(1R)-6-hydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid

Product Availability

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1 package records0 with current stock1 grade group
Batch No.PackageAvailabilityLead TimeInquiry
Batchno.20260421 100mg / 250mg Out of stock 1 business days Inquiry
  • Product code: SSC-049134
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Historical Factory Record

Historical Supply Reference

This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.

  • Pack sizes on record: 1g
  • Available purity: ≥95%
  • Inventory rows with stock: 0
  • Bulk packaging: confirmed by inquiry
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Reference Pack Sizes

Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1389890-72-5
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g ≥95% 0 Out of Stock Shenzhen Inquiry

1389890-72-5 / (1R)-6-hydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid

Standard CAS: 1389890-72-5 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1389890-72-5
Multi CAS
No
Molecular Formula
C10H11NO3
Molecular Weight
193.200000
Exact Mass
193.073893
SMILES
C1CN[C@H](C2=C1C=C(C=C2)O)C(=O)O
InChI
InChI=1S/C10H11NO3/c12-7-1-2-8-6(5-7)3-4-11-9(8)10(13)14/h1-2,5,9,11-12H,3-4H2,(H,13,14)/t9-/m1/s1
InChIKey
WQTOOVAQGWLHKC-SECBINFHSA-N

Computed Properties

Structural Parameters

Heavy atom count
14
Aromatic heavy atom count
6
Fraction Csp3
0.3
Rotatable bonds
1
H-bond acceptors
3
H-bond donors
3
Molar refractivity
50.19
TPSA
69.56

LogP / Solubility

WLOGP
0.66
MLOGP
0.58
XLogP3
-1.5
Consensus LogP
-0.09
Log S (ESOL)
-1.71
Class (ESOL)
Soluble
Log S (Ali)
-1.62
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.59
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)
-3.43

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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