Overview
PT-141 is listed in PubChem as Bremelanotide (CID 9941379), with the molecular formula C50H68N14O10 and a molecular weight of 1025.2 g/mol. Other names in PubChem include PT141, PT 141. It is supplied as a lyophilized powder in sealed 10 mg vials.
Volume pricing: 5+ vials save 5%, 10+ vials save 10%. It applies automatically in the cart and stacks with coupon codes.
Molecular profile
| PubChem name | Bremelanotide |
|---|---|
| Also known as (PubChem) | PT141, PT 141 |
| Molecular formula | C50H68N14O10 |
| Molecular weight | 1025.2 g/mol |
| CAS number | 189691-06-3 |
| PubChem CID | 9941379 |
Computed properties (PubChem)
| Exact mass | 1024.5243 Da |
|---|---|
| Monoisotopic mass | 1024.5243 Da |
| XLogP3 | 0.7 |
| Topological polar surface area | 379 Ų |
| Hydrogen bond donors | 13 |
| Hydrogen bond acceptors | 12 |
| Rotatable bonds | 17 |
| Heavy atoms | 74 |
| Formal charge | 0 |
| Complexity | 1950 |
| Defined stereocenters | 7 of 7 |
Identifiers (PubChem)
| InChIKey | FFHBJDQSGDNCIV-MFVUMRCOSA-N |
|---|---|
| SMILES | CCCC[C@@H](C(=O)N[C@H]1CC(=O)NCCCC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](NC(=O)[C@@H](NC1=O)CC2=CN=CN2)CC3=CC=CC=C3)CCCN=C(N)N)CC4=CNC5=CC=CC=C54)C(=O)O)NC(=O)C |
| UNII | 6Y24O4F92S |
| ChEMBL ID | CHEMBL2070241 |
IUPAC name (PubChem)
(3S,6S,9R,12S,15S,23S)-15-[[(2S)-2-acetamidohexanoyl]amino]-9-benzyl-6-[3-(diaminomethylideneamino)propyl]-12-(1H-imidazol-5-ylmethyl)-3-(1H-indol-3-ylmethyl)-2,5,8,11,14,17-hexaoxo-1,4,7,10,13,18-hexazacyclotricosane-23-carboxylic acid
Source: PubChem compound 9941379