CS-1002744
N-[trans-3-(Methyl-7H-pyrrolo[2,3-d]pyrimidin-4-ylamino)cyclobutyl]-1-propanesulfonamide
Manufacturer: ChemScene
CAS Number: 2204280-33-9
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₁₄H₂₁N₅O₂S
Molecular Weight
323.41
Synonyms
None
SMILES
N(C)(C1=C2C(NC=C2)=NC=N1)[C@H]3C[C@H](NS(CCC)(=O)=O)C3
Tpsa
90.98
Logp
1.2545
H Acceptors
5
H Donors
2
Rotatable Bonds
6
SAFETY INFORMATION
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₄H₂₁N₅O₂S
Molecular Weight: 323.41
Synonyms: None
SMILES: N(C)(C1=C2C(NC=C2)=NC=N1)[C@H]3C[C@H](NS(CCC)(=O)=O)C3
Tpsa: 90.98
Logp: 1.2545
H Acceptors: 5
H Donors: 2
Rotatable Bonds: 6
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₄H₂₁N₅O₂S
Molecular Weight:
323.41
Synonyms:
None
SMILES:
N(C)(C1=C2C(NC=C2)=NC=N1)[C@H]3C[C@H](NS(CCC)(=O)=O)C3
Tpsa:
90.98
Logp:
1.2545
H Acceptors:
5
H Donors:
2
Rotatable Bonds:
6
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₇H₃₄ClN₇O₃
Molecular Weight: 540.06
Synonyms: None
SMILES: O=C(OC(C)(C)C)N1CCN(C2=CN=C(C=C2)NC=3C(=O)N(C=4N=C(Cl)N=CC4C3C)C5CCCC5)CC1
Tpsa: 105.48
Logp: 5.06412
H Acceptors: 9
H Donors: 1
Rotatable Bonds: 4
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₇H₃₄ClN₇O₃
Molecular Weight:
540.06
Synonyms:
None
SMILES:
O=C(OC(C)(C)C)N1CCN(C2=CN=C(C=C2)NC=3C(=O)N(C=4N=C(Cl)N=CC4C3C)C5CCCC5)CC1
Tpsa:
105.48
Logp:
5.06412
H Acceptors:
9
H Donors:
1
Rotatable Bonds:
4
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₃₈H₃₁N₃O₉
Molecular Weight: 673.67
Synonyms: None
SMILES: O(C(=O)C1=CC=CC=C1)[C@@]2(C)[C@@H](O[C@H](COC(=O)C3=CC=CC=C3)[C@H]2OC(=O)C4=CC=CC=C4)N5C(=O)N=C(NC(=O)C6=CC=CC=C6)C=C5
Tpsa: 152.12
Logp: 5.0913
H Acceptors: 11
H Donors: 1
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₃₈H₃₁N₃O₉
Molecular Weight:
673.67
Synonyms:
None
SMILES:
O(C(=O)C1=CC=CC=C1)[C@@]2(C)[C@@H](O[C@H](COC(=O)C3=CC=CC=C3)[C@H]2OC(=O)C4=CC=CC=C4)N5C(=O)N=C(NC(=O)C6=CC=CC=C6)C=C5
Tpsa:
152.12
Logp:
5.0913
H Acceptors:
11
H Donors:
1
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₁H₃₄N₆O₈S
Molecular Weight: 530.60
Synonyms: None
SMILES: N(C1=C2C(N(N=N2)[C@@H]3C[C@H](OCCO)[C@@H](O)[C@H]3O)=NC(SCCC)=N1)[C@@H]4C[C@H](OCCO)[C@@H](O)[C@H]4O
Tpsa: 208.36
Logp: -1.949
H Acceptors: 15
H Donors: 7
Rotatable Bonds: 12
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₁H₃₄N₆O₈S
Molecular Weight:
530.60
Synonyms:
None
SMILES:
N(C1=C2C(N(N=N2)[C@@H]3C[C@H](OCCO)[C@@H](O)[C@H]3O)=NC(SCCC)=N1)[C@@H]4C[C@H](OCCO)[C@@H](O)[C@H]4O
Tpsa:
208.36
Logp:
-1.949
H Acceptors:
15
H Donors:
7
Rotatable Bonds:
12