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CAS 1141669-69-3 2-Amino-5-Cbz-4,5,6,7-tetrahydro-1,3-thiazolo[5,4-c]pyridine molecular structure lightbox
CAS RN: 1141669-69-3

2-Amino-5-Cbz-4,5,6,7-tetrahydro-1,3-thiazolo[5,4-c]pyridine

  • Product code: SSC-014041
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Verified Factory Data

Supply Overview & Packaging Options

Packaging options, recorded purity, stock quantity and ship-from location below are generated from the current factory data table for this CAS.

  • Pack sizes on record: 1g, 5g, 0.1g, 0.25g
  • Available purity: >95%
  • Inventory rows with stock: 4
  • Bulk packaging: confirmed by inquiry
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Available Pack Sizes & Stock

Specific stock quantities are shown below. Price is not displayed online and is confirmed by inquiry.

Recorded sizes, purity and stock details for CAS 1141669-69-3
Pack Size Recorded Purity Available Qty Ship From Inquiry
1g >95% 5 In Stock Beijing Inquiry
5g >95% 3 In Stock Hong Kong Inquiry
0.1g >95% 2 In Stock Shenzhen Inquiry
0.25g >95% 2 In Stock Shanghai Inquiry

1141669-69-3 / benzyl 2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-5-carboxylate

2-Amino-5-Cbz-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine | 2-AMINO-5-CBZ-4,5,6,7-TETRAHYDRO-1,3-THIAZOLO[5,4-C]PYRIDINE | MFCD11656828

Standard CAS: 1141669-69-3 Multi CAS: No
Basic Information Computed Properties

Basic Information

CAS
1141669-69-3
Multi CAS
No
Molecular Formula
C14H15N3O2S
Molecular Weight
289.350000
Exact Mass
289.088498
SMILES
C1CN(CC2=C1N=C(S2)N)C(=O)OCC3=CC=CC=C3
InChI
InChI=1S/C14H15N3O2S/c15-13-16-11-6-7-17(8-12(11)20-13)14(18)19-9-10-4-2-1-3-5-10/h1-5H,6-9H2,(H2,15,16)
InChIKey
WZTQWXKHLAJTRC-UHFFFAOYSA-N
Synonyms
2-Amino-5-Cbz-4,5,6,7-tetrahydrothiazolo[5,4-c]pyridine 2-AMINO-5-CBZ-4,5,6,7-TETRAHYDRO-1,3-THIAZOLO[5,4-C]PYRIDINE MFCD11656828 Benzyl 2-amino-6,7-dihydrothiazolo[5,4-c]pyridine-5(4H)-carboxylate benzyl 2-amino-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridine-5-carboxylate

Computed Properties

Structural Parameters

Heavy atom count
20
Aromatic heavy atom count
11
Fraction Csp3
0.29
Rotatable bonds
2
H-bond acceptors
5
H-bond donors
1
Molar refractivity
77.27
TPSA
68.45

LogP / Solubility

WLOGP
2.42
MLOGP
2.14
XLogP3
1.9
Consensus LogP
2.15
Log S (ESOL)
-3.43
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.68
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.79
Class (SILICOS-IT)
Poorly soluble

ADME

GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.77

Drug-likeness / Medicinal Chemistry

Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5

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