![CAS 1638760-44-7 5-Methyl-7H-pyrrolo[2,3-d]pyrimidine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1638760-44-7.gif)
CAS RN: 1638760-44-7
5-Methyl-7H-pyrrolo[2,3-d]pyrimidine
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.20250322 | 1g | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS1638760-44-7
- Purity/Analytical Methods: >99.0%
1638760-44-7 / 5-methyl-7H-pyrrolo[2,3-d]pyrimidine
Basic Information
CAS
1638760-44-7
Multi CAS
No
Molecular Formula
C7H7N3
Molecular Weight
133.150000
Exact Mass
133.063997
SMILES
CC1=CNC2=NC=NC=C12
InChI
InChI=1S/C7H7N3/c1-5-2-9-7-6(5)3-8-4-10-7/h2-4H,1H3,(H,8,9,10)
InChIKey
FOQWCSIQBWFFOM-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
10
Aromatic heavy atom count
9
Fraction Csp3
0.14
H-bond acceptors
2
H-bond donors
1
Molar refractivity
38.63
TPSA
41.57
LogP / Solubility
WLOGP
1.27
MLOGP
1.11
XLogP3
1
Consensus LogP
1.13
Log S (ESOL)
-2.13
Class (ESOL)
Moderately soluble
Log S (Ali)
-1.57
Class (Ali)
Soluble
Log S (SILICOS-IT)
-1.58
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)
-2.63
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
No
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
![CAS 1638760-47-0 7H-Pyrrolo[2,3-d]pyrimidine, 2,4-dichloro-6-iodo- molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
7H-Pyrrolo[2,3-d]pyrimidine, 2,4-dichloro-6-iodo-
- CAS RN: 1638760-47-0
- Product Code: SSC-071320
-
METHYL 3-BROMO-1H-PYRROLO[2,3-B]PYRIDINE-6-CARBOXYLATE
- CAS RN: 1638760-65-2
- Product Code: SSC-071322
-
2-chloro-6-iodo-7-(phenylsulfonyl)-7h-pyrrolo[2,3-d]pyrimidine
- CAS RN: 1638760-67-4
- Product Code: SSC-071323
-
2,4-dichloro-7H-pyrrolo[2,3-d]pyriMidine-6-carboxylic acid
- CAS RN: 1638760-72-1
- Product Code: SSC-071325
-
methyl 2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate
- CAS RN: 1638760-75-4
- Product Code: SSC-071326
-
![CAS 1638760-47-0 7H-Pyrrolo[2,3-d]pyrimidine, 2,4-dichloro-6-iodo- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1638760-47-0.gif)
![CAS 1638760-65-2 METHYL 3-BROMO-1H-PYRROLO[2,3-B]PYRIDINE-6-CARBOXYLATE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1638760-65-2.gif)
![CAS 1638760-67-4 2-chloro-6-iodo-7-(phenylsulfonyl)-7h-pyrrolo[2,3-d]pyrimidine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1638760-67-4.gif)
![CAS 1638760-72-1 2,4-dichloro-7H-pyrrolo[2,3-d]pyriMidine-6-carboxylic acid molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/CB92653922.gif)
![CAS 1638760-75-4 methyl 2,4-dichloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1638760-75-4.gif)
