CAS RN: 1026287-65-9
2-chloro-N-(thiophen-2-ylmethyl)quinazolin-4-amine
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20260102 | 250mg / 1g / 5g | Out of stock | 15 business days | Inquiry |
- Product code: SSC-003911
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
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Shenzhen | Inquiry |
1026287-65-9 / 2-chloro-N-(thiophen-2-ylmethyl)quinazolin-4-amine
2-chloro-N-(thiophen-2-ylmethyl)quinazolin-4-amine | MFCD17348617 | 2-chloro-N-(2-thienylmethyl)quinazolin-4-amine
Basic Information
CAS
1026287-65-9
Multi CAS
No
Molecular Formula
C13H10ClN3S
Molecular Weight
275.760000
Exact Mass
275.028396
SMILES
C1=CC=C2C(=C1)C(=NC(=N2)Cl)NCC3=CC=CS3
InChI
InChI=1S/C13H10ClN3S/c14-13-16-11-6-2-1-5-10(11)12(17-13)15-8-9-4-3-7-18-9/h1-7H,8H2,(H,15,16,17)
InChIKey
CVAMKMNWQVMRDG-UHFFFAOYSA-N
Synonyms
2-chloro-N-(thiophen-2-ylmethyl)quinazolin-4-amine
MFCD17348617
2-chloro-N-(2-thienylmethyl)quinazolin-4-amine
SCHEMBL3643331
AKOS006092568
Computed Properties
Structural Parameters
Heavy atom count
18
Aromatic heavy atom count
15
Fraction Csp3
0.08
Rotatable bonds
3
H-bond acceptors
4
H-bond donors
1
Molar refractivity
76.19
TPSA
37.81
LogP / Solubility
WLOGP
3.96
MLOGP
3.49
XLogP3
4
Consensus LogP
3.82
Log S (ESOL)
-4.46
Class (ESOL)
Slightly soluble
Log S (Ali)
-4.68
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-5.1
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-1.59
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
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