![CAS 43040-76-2 Bansyl Chloride [N-Protecting Agent for Peptide Research] molecular structure](https://starshinechemical.com/wp-content/uploads/2022/03/b0994-jpgcontextbwfzdgvyfhjvb3r8ntezndl8aw1hz2uvanblz3xomjqvadqwlzg5mjg2mdi4mty1ndivqja5otquanbnfduwmmjmnjizodi4yji1ngyyowjhmdbhnwq5nwy3ntg4nmvlzwvkmdkwmmyyothintdiodu2ngjhzjvizjgznmu.jpeg)
CAS RN: 43040-76-2
Bansyl Chloride [N-Protecting Agent for Peptide Research]
- Product code: SSC-151348
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 |
43040-76-2 / 5-(dibutylamino)naphthalene-1-sulfonyl chloride
Basic Information
CAS
43040-76-2
Multi CAS
Yes
Molecular Formula
C18H24CLNO2S
Molecular Weight
353.900000
Exact Mass
353.121628
InChI
InChI=1S/C18H24ClNO2S/c1-3-5-13-20(14-6-4-2)17-11-7-10-16-15(17)9-8-12-18(16)23(19,21)22/h7-12H,3-6,13-14H2,1-2H3
InChIKey
PIZHBGYIKYGXBV-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Aromatic heavy atom count
10
Fraction Csp3
0.44
Rotatable bonds
8
H-bond acceptors
3
Molar refractivity
99.02
TPSA
37.38
LogP / Solubility
WLOGP
5.17
MLOGP
4.57
XLogP3
6
Consensus LogP
5.25
Log S (ESOL)
-5.09
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.2
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-7.21
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.21
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2.5
